Vitas-M small molecule compound
4-({(E)-[3-methyl-1-(2-methylphenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)benzoic acid
Catalog ID
STL294988
SMILES CC1=NN(C(=O)/C/1=C/Nc1ccc(cc1)C(=O)O)c1ccccc1C
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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 C19H17N3O3 MW 335.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N3O3/c1-12-5-3-4-6-17(12)22-18(23)16(13(2)21-22)11-20-15-9-7-14(8-10-15)19(24)25/h3-11,20H,1-2H3,(H,24,25)/b16-11+InChIKey
JHEMIWBYLBYJGU-LFIBNONCSA-NSynonyms
4(((3METHYL1(2METHYLPHENYL)5OXO12DIAZOLIN4YLIDENE)METHYL)AMINO)BENZOICACID
4(((E)(3methyl1(2methylphenyl)5oxo15dihydro4Hpyrazol4ylidene)methyl)amino)benzoicacid
4(((E)(3METHYL1(2METHYLPHENYL)5OXOPYRAZOL4YLIDENE)METHYL)AMINO)BENZOICACID
CC1=CC=CC=C1N2C(=O)C(=CNC3=CC=C(C=C3)C(=O)O)C(=N2)C
CC1=NN(C(=O)C1=CNc1ccc(cc1)C(=O)O)c1ccccc1C
InChI=1SC19H17N3O3c112534617(12)2218(23)16(13(2)2122)1120159714(81015)19(24)25h31120H12H3(H2425)b1611+
MFCD00697268
ZINC000019119025
ZINC19119025
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