Vitas-M small molecule compound
(2Z)-2-cyano-N-(3-methylphenyl)-3-[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enamide
Catalog ID
STK820382
SMILES N#C/C(=C/c1cn(nc1c1ccc(cc1)C)c1ccccc1)/C(=O)Nc1cccc(c1)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 C27H22N4O MW 418.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N4O/c1-19-11-13-21(14-12-19)26-23(18-31(30-26)25-9-4-3-5-10-25)16-22(17-28)27(32)29-24-8-6-7-20(2)15-24/h3-16,18H,1-2H3,(H,29,32)/b22-16-InChIKey
ZKIXMFAOVGFHAI-JWGURIENSA-NSynonyms
(2Z)2cyanoN(3methylphenyl)3(3(4methylphenyl)1phenyl1Hpyrazol4yl)prop2enamide
(Z)2cyanoN(3methylphenyl)3(3(4methylphenyl)1phenylpyrazol4yl)prop2enamide
CC1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NC3=CC=CC(=C3)C)C4=CC=CC=C4
InChI=1SC27H22N4Oc119111321(141219)2623(1831(3026)2594351025)1622(1728)27(32)292486720(2)1524h31618H12H3(H2932)b2216
MFCD06644913
N#CC(=Cc1cn(nc1c1ccc(cc1)C)c1ccccc1)C(=O)Nc1cccc(c1)C
ZINC000016806147
ZINC16806147
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