Vitas-M small molecule compound
4-{(Z)-[3-methyl-1-(4-methylphenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}benzoic acid
Catalog ID
STK354371
SMILES Cc1ccc(cc1)N1N=C(/C(=C/c2ccc(cc2)C(=O)O)/C1=O)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C19H16N2O3 MW 320.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N2O3/c1-12-3-9-16(10-4-12)21-18(22)17(13(2)20-21)11-14-5-7-15(8-6-14)19(23)24/h3-11H,1-2H3,(H,23,24)/b17-11-InChIKey
JZEIMWMFKPFPEG-BOPFTXTBSA-NSynonyms
4((Z)(3methyl1(4methylphenyl)5oxo15dihydro4Hpyrazol4ylidene)methyl)benzoicacid
4((Z)(3methyl1(4methylphenyl)5oxopyrazol4ylidene)methyl)benzoicacid
CC1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(C=C3)C(=O)O)C(=N2)C
Cc1ccc(cc1)N1N=C(C(=Cc2ccc(cc2)C(=O)O)C1=O)C
InChI=1SC19H16N2O3c1123916(10412)2118(22)17(13(2)2021)11145715(8614)19(23)24h311H12H3(H2324)b1711
MFCD11851583
ZINC000020085934
ZINC20085934
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