Tag: M.W:100-200

2075-46-9, Name is 4-Nitro-1H-pyrazole, molecular formula is C3H3N3O2, belongs to pyrazoles-derivatives compound, is a common compound. In a patnet, author is Nagaraja, Manju, once mentioned the new application about 2075-46-9, Recommanded Product: 4-Nitro-1H-pyrazole.

Synthesis of chalcone precursor via Cu(I) catalyzed 1,3-dipolar reaction of functionalized acetylene and pyrazole embedded dipole

A new class of functionalized pyrazole bearing 1,2,3-triazole has been synthesized via Cu(I) mediated 1,3-dipolar cycloaddition of pyrazole bearing azide with various aromatic/heteroaromatic bearing terminal dipolarophile (acetylene). Structures of the newly synthesized compounds were explicated by analytical and spectral analysis. All the newly synthesized compounds were evaluated for their in-vitro antibacterial and antioxidant activity. Among the synthesized compound, triazole bearing 2,5-thiazolidinone5b(20 +/- 0.70) and triazole bearing thiocarboamide5e(19 +/- 0.70) showed good antibacterial activity againstEscherichia coliandPseudomonas aeruginosa, respectively. The newly synthesized compounds further tested for their ability to bleach DPPH radical using DPPH scavenging assay. Among the synthesized compounds 1,2,3-triazole bearing 2,5-thiazolidinone5b(58.81%) exhibited good DPPH scavenging activity compared to the rest of the compounds. From the X-ray and Hirshfield analysis, it was observed that compound3, crystallizes in a triclinic crystal system with a P-1 space group. The major intercontacts present in these molecules are H horizontal ellipsis H (39.7%), C horizontal ellipsis H (23.9%), N horizontal ellipsis H (20.3%).

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Pyrazole – Wikipedia,
,Pyrazoles – an overview | ScienceDirect Topics

Reactions catalyzed within inorganic and organic materials and at electrochemical interfaces commonly occur at high coverage and in condensed media, causing turnover rates to depend strongly on interfacial structure and composition, 37622-90-5, Name is Ethyl 4-pyrazolecarboxylate, SMILES is C1=N[NH]C=C1C(OCC)=O, in an article , author is Zhan, Shun-Ze, once mentioned of 37622-90-5, Product Details of 37622-90-5.

Luminescent polymorphic aggregates of trinuclear Cu(I)-pyrazolate tuned by intertrimeric Cu center dot center dot center dot N-Py weak coordination bonds

Five luminescent polymorphic aggregates of trinuclear Cu(I)-pyrazolate, namely [anti-Cu3L3](2) (1), [syn-Cu3L3 center dot C2H5OH](2) (2), [anti-Cu3L3 center dot C2H5OH](n) (3), [anti-Cu3L3 center dot 0.5C(7)H(8)](n) (4) and [syn-Cu3L3 center dot C8H10](n) (5) (HL = 4-(pyridin-4-ylthio)-3,5-dimethyl-1H-pyrazole), were reported. The trimeric Cu3L3 fragments present syn- and anti-conformations dependent on the dangled direction of 4-pyridyl groups on the two sides of the Cu(3)Pz(3) plane (Pz = pyrazolate). Intertrimeric N-Py center dot center dot center dot Cu weak coordination bonds associate these Cu3L3 fragments together to form dimeric or polymeric structures, which are further stabilized by crystallized solvent molecules or intertrimeric Cu center dot center dot center dot Cu interactions. The solvated complexes (3-5) may be transformed into the unsolvated complex 1 by evacuation of the crystallized solvents upon heating. All these complexes emit from green to yellow under UV irradiation, which originated from the triplet excited states of metal to ligand charge transfer ((MLCT)-M-3) mixed with intertrimeric Cu center dot center dot center dot Cu interactions. This work provides a novel kind of supramolecular aggregate based on Cu(3)Pz(3) beyond the classical pi-acid center dot center dot center dot base adducts and metallophilicity-dependent dimers/oligomers.

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Pyrazole – Wikipedia,
,Pyrazoles – an overview | ScienceDirect Topics

Chemistry is traditionally divided into organic and inorganic chemistry. The former is the study of compounds containing at least one carbon-hydrogen bonds. 2075-46-9, Name is 4-Nitro-1H-pyrazole, molecular formula is C3H3N3O2, belongs to pyrazoles-derivatives compound, is a common compound. In a patnet, author is Dawood, Dina H., once mentioned the new application about 2075-46-9, Recommanded Product: 2075-46-9.

Synthesis and molecular docking study of new pyrazole derivatives as potent anti-breast cancer agents targeting VEGFR-2 kinase

Based on the previous studies that revealed the valuable role of pyrazole scaffold in cancer management and VEGFR-2 inhibition, a new set of pyrazole conjugated with pyrazoline, triazolopyrimidine and pyrazolone moieties were synthesized and investigated for their anticancer efficiency against human breast cancer MCF-7. The anticancer screening revealed the significant sensitivity of breast carcinoma towards compounds 4b, 5c, 6c, 7b, 7c and 12c with IC50 values ranging from 16.50 – 26.73 mu M in comparison with tamoxifen (IC50 = 23.31 mu M). Moreover, the new analogues were further examined for their VEGFR-2 inhibitory activity, among the tested derivatives 5c, 6c, 7b, 7c and 12c displayed prominent inhibitory efficiency versus VEGFR-2 kinase with % inhibition ranging from 70 to 79%. Compounds 6c, 7c and 12c revealed inhibitory efficiency in nanomolar level with IC50 (913.51, 225.17 and 828.23 nM, respectively) comparing to sorafenib (IC50 = 186.54 nM). Flow cytometric analysis revealed that the promising compound 12c prompted pre-G1 apoptosis and cell growth cessation at G2/M phase and stimulated apoptosis via activation of caspase-3. Moreover, molecular docking study of the promising derivatives was performed to highlight their binding modes and interactions with the amino acid residues of VEGFR-2 enzyme.

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Reference:
Pyrazole – Wikipedia,
,Pyrazoles – an overview | ScienceDirect Topics

A catalyst don’t appear in the overall stoichiometry of the reaction it catalyzes, but it must appear in at least one of the elementary reactions in the mechanism for the catalyzed reaction. 5932-27-4, Name is Ethyl 1H-pyrazole-3-carboxylate, molecular formula is C6H8N2O2. In an article, author is Jadhav, S. Y.,once mentioned of 5932-27-4, Formula: C6H8N2O2.

Synthesis and Pharmacological Screening of Difluorophenyl Pyrazole Chalcone Conjugates as Antifungal, Anti-Inflammatory, and Antioxidant Agents

A new series of difluoro phenyl pyrazole chalcone was prepared by utilizing PEG 400 as a catalyst and investigated for their antifungal, anti-inflammatory, and antioxidant activity. The compounds 3-[3-(4-bromo-phenyl)-1-phenyl-1H-pyrazol-4-yl]-1-(2,4-difluloro-phenyl)-propenone (IVc), 1-(2,4-difluoro-phenyl)-3-[3-(4-methyl-phenyl)-1-phenyl-1H-pyrazol-4-yl]-propenone (IVd), 1-(2,4-difluoro-phenyl)-3-[3-(4-methoxy-phenyl)-1-phenyl-1H-pyrazol-4-yl]-propenone (IVe), and 1-(2,4-difluoro-phenyl)-3-(1,3-diphenyl-1H-pyrazol-4-yl)-propenone (IVg) exhibited promising antifungal activity at MIC of 25 and 50 mu g/mL against selected human pathogenic fungi. Synthesized compounds 1-(2,4-difluoro-phenyl)-3-[3-(4-methoxy-phenyl)-1-phenyl-1H-pyrazol-4-yl]-propenone (IVe), 1-(2,4-difluoro-phenyl)-3-[3-(4-methyl-phenyl)-1-phenyl-1H-pyrazol-4-yl]-propenone (IVd), 1-(2,4-difluoro-phenyl)-3-(1,3-diphenyl-1H-pyrazol-4-yl)-propenone (IVg) and 1-(2,4-difluoro-phenyl)-3-[3-(4-fluoro-phenyl)-1-phenyl-1H-pyrazol-4-yl]-propenone (IVa) showed good anti-inflammatory activities comparable to the standard drug diclofenac sodium. Compounds 1-(2,4-difluoro-phenyl)-3-[3-(4-methoxy-phenyl)-1-phenyl-1H-pyrazol-4-yl]-propenone (IVe), 1-(2,4-difluoro-phenyl)-3-[3-(4-methyl-phenyl)-1-phenyl-1H-pyrazol-4-yl]-propenone (IVd) and 1-(2,4-difluoro-phenyl)-3-(1,3-diphenyl-1H-pyrazol-4-yl)-propenone (IVg) showed good hydrogen peroxide scavenging potential as compared to the butylated hydroxyl toluene. The conjugates 1-(2,4-difluoro-phenyl)-3-[3-(4-methoxy-phenyl)-1-phenyl-1H-pyrazol-4-yl]-propenone (IVe), 1-(2,4-difluoro-phenyl)-3-(1,3-diphenyl-1H-pyrazol-4-yl)-propenone (IVg), and 1-(2,4-difluoro-phenyl)-3-[3-(4-methyl-phenyl)-1-phenyl-1H-pyrazol-4-yl]-propenone (IVd) found more potent than standard ascorbic acid in DPPH radical scavenging assay as well as ferrous reducing power assay. The conjugates showed good interactions with the target protein in docking study.

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Reference:
Pyrazole – Wikipedia,
,Pyrazoles – an overview | ScienceDirect Topics

Chemistry is the experimental science by definition. We want to make observations to prove hypothesis. For this purpose, we perform experiments in the lab. , Safety of 3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid, 176969-34-9, Name is 3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid, molecular formula is C6H6F2N2O2, belongs to pyrazoles-derivatives compound. In a document, author is Chen, Xing-Wei, introduce the new discover.

Mechanochromic luminescent materials of bimetallic Cu(i) complexes showing thermally activated delayed fluorescence

Mechanochromic luminescence has recently received increasing interest due to its promising applications. Herein we report a new series of ionic bimetallic Cu(i) complexes exhibiting reversible mechanochromic luminescence and thermally activated delayed fluorescence. These Cu(i) complexes possess one emissive [{Cu((NN)-N-boolean AND)}(2)(mu-dppm)(2)](2+) cation with two N-H groups in two functional 3-(2 ‘-pyridyl)pyrazole ((NN)-N-boolean AND) ligands, and each N-H proton forms a N-HMIDLINE HORIZONTAL ELLIPSISO hydrogen bond with one O atom of a counterion ClO4-. It is shown that reversible mechanochromic luminescence is relevant to the breaking and restoring of the NHMIDLINE HORIZONTAL ELLIPSISO hydrogen bonds controlled by mechanical grinding and CH2Cl2 vapor, which is well supported by their FT-IR analyses. Importantly, the difference of those two inter-convertible luminous colors appearing in luminescence mechanochromism can be effectively regulated by altering the electronic nature of the substituent on the pyrazole ring such as the trifluoromethyl and tert-butyl. This clearly suggests that rationally designed Cu(i) luminescent complexes can become promising candidates for developing low-cost intelligent responsive luminescence materials.

A reaction mechanism is the microscopic path by which reactants are transformed into products. Each step is an elementary reaction. In my other articles, you can also check out more blogs about 176969-34-9. Safety of 3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid.

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Pyrazole – Wikipedia,
,Pyrazoles – an overview | ScienceDirect Topics

The reaction rate of a catalyzed reaction is faster than the reaction rate of the uncatalyzed reaction at the same temperature. 176969-34-9, Name is 3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid, SMILES is O=C(C1=CN(C)N=C1C(F)F)O, in an article , author is Merillas, Beatriz, once mentioned of 176969-34-9, Quality Control of 3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid.

Luminescent Rhenium(I)tricarbonyl Complexes Containing Different Pyrazoles and Their Successive Deprotonation Products: CO2 Reduction Electrocatalysts

Cationic fac-[Re(CO)(3)(pz*H)(pypzH)]OTf (pz*H = pyrazole, pzH; 3,5-dimethylpyrazole, dmpzH; indazole, indzH; 3-(2-pyridyl)pyrazole, pypzH) were obtained from fac[ReBr(CO)(3)(pypzH)] by halide abstraction with AgOTf and subsequent addition of the corresponding pyrazole. Successive deprotonation with Na2CO3 and NaOH gave neutral fac[Re(CO)(3)(pz*H)(pypz)] and anionic Na{fac-[Re(CO)(3)(pz*)(pypz)]} complexes, respectively. Cationic fac-[Re(CO)(3)(pz*H)(pypzH)]OTf, neutral complexes fac-[Re(CO)(3)(pz*H)(pypz)], and fac-[Re(CO)(3)(pypz)(2)Na] were subjected to photophysical and electrochemical studies. They exhibit phosphorescent decays from a prevalently (MLCT)-M-3 excited state with quantum yields (F) in the range between 0.03 and 0.58 and long lifetimes (tau from 220 to 869 ns). The electrochemical behavior in Ar atmosphere of cationic and neutral complexes indicates that the oxidation processes assigned to Re-I -> Re-II occurs at lower potentials for the neutral complex compared to cationic complex. The reduction processes occur at the ligands and do not depend on the charge of the complexes. The electrochemical behavior in CO2 saturated media is consistent with CO2 electrocatalyzed reduction, where the values of the catalytic activity [i(cat)(CO2)/i(cat)(Ar)] ranged from 2.7 to 11.5 (compared to 8.1 for fac-[Re(CO)(3)Cl(bipy)] studied as a reference). Controlled potential electrolysis for the pyrazole cationic (3a) and neutral (4a) complexes after 1 h affords CO in faraday yields of 61 and 89%, respectively. These values are higher for indazole complexes and may be related to the acidity of the coordinated pyrazole.

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Reference:
Pyrazole – Wikipedia,
,Pyrazoles – an overview | ScienceDirect Topics

Chemistry is the experimental science by definition. We want to make observations to prove hypothesis. For this purpose, we perform experiments in the lab. , Recommanded Product: 176969-34-9, 176969-34-9, Name is 3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid, molecular formula is C6H6F2N2O2, belongs to pyrazoles-derivatives compound. In a document, author is Ibrahim, Magdy A., introduce the new discover.

SYNTHETIC APPROACH FOR BUILDING HETEROANNULATED FURO[3,2-g]CHROMENES USING 4,9-DIMETHOXY-5-OXO-5H-FURO[3,2-g]CHROMENE-6-CARBONITRILE AND CYCLIC CARBON NUCLEOPHILE

A novel series of polyfused heterocyclic systems containing furo[3,2-g]chromenes were efficiently synthesized. The reactivity of 4,9-dimethoxy-5-oxo-5H-furo[3,2-g]chromene-6-carbonitrile (1) was studied towards a variety of carbon nucleophilic reagents such as heterocyclic enols, heterocyclic enamines and cyclic active methylene compounds. Treatment of carbonitrile 1 with 4-hydroxycoumarin, 4-hydroxy-1-methylquinolin-2(1H)-one (3), 2-hydroxy-4H-pyrido[1,2-a]pyrimidin-4-one (4) afforded furodichromenopyridine 2, furochromenonaphthyridine 5, furochromenodipyridopyrimidine 6. Reaction of carbonitrile 1 with 4(6)-aminouracil and 5-amino-3-methyl-1H-pyrazole proceed through ring opening followed by cycloaddition into the nitrile group giving pyrido[2,3-d]pyrimidine 7 and pyrazolo[3,4-b]pyridine 8. Also, reaction of carbonitrile 1 with 5-amino-2,4-dihydro-3H-pyrazol-3-one (9), 2-(phenylimino)-1,3-thiazolidin-4-one (11), thiobarbituric acid and cyclohexane-1,3-dione produced the novel annulated furo[3,2-g]chromenes 10, 12-14, respectively. Cyclohexane-1,2-dione reacted with carbonitrile 1 in 1:2 molar ratio afforded bis-(furochromeno)[1,10]phenanthroline 15. The prepared compounds were screened in vitro for their antimicrobial activity and some of them appeared notable activity against the tested microorganisms.

A reaction mechanism is the microscopic path by which reactants are transformed into products. Each step is an elementary reaction. In my other articles, you can also check out more blogs about 176969-34-9. Recommanded Product: 176969-34-9.

Reference:
Pyrazole – Wikipedia,
,Pyrazoles – an overview | ScienceDirect Topics

Chemistry can be defined as the study of matter and the changes it undergoes. You¡¯ll sometimes hear it called the central science because it is the connection between physics and all the other sciences, starting with biology. 1985-46-2, Name is N2,N2-Dimethyl-1,3,5-triazine-2,4,6-triamine, molecular formula is , belongs to pyrazoles-derivatives compound. In a document, author is Sever, Belgin, Category: pyrazoles-derivatives.

Pyrazole Incorporated New Thiosemicarbazones: Design, Synthesis and Investigation of DPP-4 Inhibitory Effects

Dipeptidyl peptidase-4 (DPP-4) inhibition has been recognized as a promising approach to develop safe and potent antidiabetic agents for the management of type 2 diabetes. In this context, new thiosemicarbazones (2a-o) were prepared efficiently by the reaction of aromatic aldehydes with 4-[4-(1H-pyrazol-1-yl)phenyl]thiosemicarbazide (1), which was obtained via the reaction of 4-(1H-pyrazol-1-yl)phenyl isothiocyanate with hydrazine hydrate. Compounds 2a-o were evaluated for their DPP-4 inhibitory effects based on a convenient fluorescence-based assay. 4-[4-(1H-pyrazol-1-yl)phenyl]-1-(4-bromobenzylidene)thiosemicarbazide (2f) was identified as the most effective DPP-4 inhibitor in this series with an IC50 value of 1.266 +/- 0.264 nM when compared with sitagliptin (IC50 = 4.380 +/- 0.319 nM). MTT test was carried out to assess the cytotoxic effects of compounds 2a-o on NIH/3T3 mouse embryonic fibroblast (normal) cell line. According to cytotoxicity assay, compound 2f showed cytotoxicity towards NIH/3T3 cell line with an IC50 value higher than 500 mu M pointing out its favourable safety profile. Molecular docking studies indicated that compound 2f presented pi-pi interactions with Arg358 and Tyr666 via pyrazole scaffold and 4-bromophenyl substituent, respectively. Overall, in vitro and in silico studies put emphasis on that compound 2f attracts a great notice as a drug-like DPP-4 inhibitor for further antidiabetic research.

Sometimes chemists are able to propose two or more mechanisms that are consistent with the available data. If a proposed mechanism predicts the wrong experimental rate law, however, the mechanism must be incorrect.Welcome to check out more blogs about 1985-46-2, in my other articles. Category: pyrazoles-derivatives.

Reference:
Pyrazole – Wikipedia,
,Pyrazoles – an overview | ScienceDirect Topics

Chemistry, like all the natural sciences, Application In Synthesis of 3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid, begins with the direct observation of nature¡ª in this case, of matter.176969-34-9, Name is 3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid, SMILES is O=C(C1=CN(C)N=C1C(F)F)O, belongs to pyrazoles-derivatives compound. In a document, author is Baral, Khagendra R., introduce the new discover.

Nitrous oxide emissions after renovation of festulolium, and mitigation potential of 3,4-dimethyl pyrazole phosphate (DMPP)

High-yielding perennial grass can, when compared to classical grain crop production, considerably increase biomass yields per unit area in Northern European agriculture, which is important to meet the demand for biomass in a growing bioeconomy. Potential benefits for the carbon footprint will, however, depend on greenhouse gas (GHG) emissions during the entire biomass production cycle, which includes grassland renovation at regular intervals to maintain high biomass yields. The renovation phase may accelerate nitrous oxide (N2O) emissions associated with residue decomposition. This study examined the effect of renovating a six-year old festulolium (x Festulolium braunii L.) crop on N2O emissions. As a secondary objective, the study evaluated the potential for mitigating N2O emissions in spring by spraying the sward with a nitrification inhibitor containing 3,4-dimethylpyrazole phosphate (DMPP) prior to cultivation. A replicated split-plot design was used, where one half of each main plot was rotovated and seeded with spring barley (Hordeum vulgare L.) as a catch crop during spring, followed by ploughing and reseeding of festulolium in the autumn. In the other half of each main plot, festulolium was left without cultivation as reference. Four subplots were defined within both cultivated plots and reference plots with ( + DMPP) or without ( – DMPP) DMPP spraying of festulolium before cultivation, and with (F) or without (NF) fertilisation with 119, 425 and 50 kg N ha(-1) in spring barley, festulolium and re-established festulolium, respectively. All four combinations of DMPP treatment and fertilisation were represented, i.e., F + DMPP, F-DMPP, NF + DMPP and NF-DMPP. Monitoring of N2O emissions occurred in two periods, April-June (spring) and August-October (autumn). In the autumn, where festulolium was reestablished, N2O emissions were only monitored in the plots without DMPP treatment in spring, since potential legacy effects of DMPP were not part of this study. Cultivation increased N2O emissions 2.5-fold in spring, and 2-fold in autumn, compared to uncultivated plots. The N2O emissions induced by fertilisation were similar from cultivated and reference plots, and emission factors for spring barley (Apr-Jun), re-sown festulolium (Aug-Oct) and uncultivated festulolium (reference, Apr-Oct) during the monitoring periods were, respectively, 0.40, 0.42 and 0.12%. Spraying festulolium with DMPP delayed the transformation of ammonium to nitrate during spring. DMPP did not reduce N2O emissions significantly in this study. In contrast, there was an apparent interaction between decomposing residues and mineral fertiliser with respect to emissions of N2O, which is a potential GHG mitigation target.

Note that a catalyst decreases the activation energy for both the forward and the reverse reactions and hence accelerates both the forward and the reverse reactions. you can also check out more blogs about 176969-34-9. Application In Synthesis of 3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid.

Reference:
Pyrazole – Wikipedia,
,Pyrazoles – an overview | ScienceDirect Topics

Chemistry is the experimental and theoretical study of materials on their properties at both the macroscopic and microscopic levels. 4233-33-4, Name is 4-Phenyl-3H-1,2,4-triazole-3,5(4H)-dione, molecular formula is C8H5N3O2. In an article, author is Suhail, Farah,once mentioned of 4233-33-4, Name: 4-Phenyl-3H-1,2,4-triazole-3,5(4H)-dione.

Highly CO2 selective mixed matrix membranes of polysulfone based on hetaryl modified SBA-16 particles

Mixed matrix membranes were prepared by incorporating pyrazole functionalized SBA-16 type mesoporous silica as filler in polysulfone (PSf) matrix. The structure, morphology, and porosity of functionalized filler were confirmed by Fourier transform infrared (FTIR) spectra, scanning electron microscope (SEM) images, C-13 NMR spectra and N-2 adsorption-desorption analysis. A good uniform interaction of filler with polymer matrix was observed for all membranes. The porosity of filler enhanced the CO2 gas diffusivity through the membrane leading to increased CO2 permeability of up to 14.43 Barrer (116% increase) at the highest filler loading of 30%. The presence of CO2-philic functional groups resulted in a simultaneous increase in both ideal and mixed gas CO2/N-2 selectivity of 42.44 and 46.13 respectively (68.34% and 87.06% increase respectively), compared to non-functionalized filler).

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Reference:
Pyrazole – Wikipedia,
,Pyrazoles – an overview | ScienceDirect Topics