Vitas-M small molecule compound
4-{(1Z)-2-cyano-3-[(4-methylphenyl)amino]-3-oxoprop-1-en-1-yl}phenyl 4-methylbenzenesulfonate
Catalog ID
STK379129
SMILES N#C/C(=C/c1ccc(cc1)OS(=O)(=O)c1ccc(cc1)C)/C(=O)Nc1ccc(cc1)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 C24H20N2O4S MW 432.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N2O4S/c1-17-3-9-21(10-4-17)26-24(27)20(16-25)15-19-7-11-22(12-8-19)30-31(28,29)23-13-5-18(2)6-14-23/h3-15H,1-2H3,(H,26,27)/b20-15-InChIKey
CIKFKJJXYYFQPZ-HKWRFOASSA-NSynonyms
(4((Z)2cyano3(4methylanilino)3oxoprop1enyl)phenyl)4methylbenzenesulfonate
4((1Z)2cyano3((4methylphenyl)amino)3oxoprop1en1yl)phenyl4methylbenzenesulfonate
CC1=CC=C(C=C1)NC(=O)C(=CC2=CC=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)C)C#N
InChI=1SC24H20N2O4Sc1173921(10417)2624(27)20(1625)151971122(12819)3031(2829)2313518(2)61423h315H12H3(H2627)b2015
MFCD01874705
N#CC(=Cc1ccc(cc1)OS(=O)(=O)c1ccc(cc1)C)C(=O)Nc1ccc(cc1)C
ZINC000008860749
ZINC08860749
ZINC8860749
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