Vitas-M small molecule compound
(2Z)-3-[1-(4-chlorobenzyl)-1H-indol-3-yl]-2-cyano-N-(3,4-dimethylphenyl)prop-2-enamide
Catalog ID
STK070746
SMILES N#C/C(=C/c1cn(c2c1cccc2)Cc1ccc(cc1)Cl)/C(=O)Nc1ccc(c(c1)C)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 C27H22ClN3O MW 439.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22ClN3O/c1-18-7-12-24(13-19(18)2)30-27(32)21(15-29)14-22-17-31(26-6-4-3-5-25(22)26)16-20-8-10-23(28)11-9-20/h3-14,17H,16H2,1-2H3,(H,30,32)/b21-14-InChIKey
WZOFLBMNYJWDPN-STZFKDTASA-NSynonyms
(2Z)3(1(4CHLOROBENZYL)1HINDOL3YL)2CYANON(34DIMETHYLPHENYL)PROP2ENAMIDE
(Z)3(1((4CHLOROPHENYL)METHYL)INDOL3YL)2CYANON(34DIMETHYLPHENYL)PROP2ENAMIDE
CC1=C(C=C(C=C1)NC(=O)C(=CC2=CN(C3=CC=CC=C32)CC4=CC=C(C=C4)Cl)C#N)C
InChI=1SC27H22ClN3Oc11871224(1319(18)2)3027(32)21(1529)14221731(26643525(22)26)162081023(28)11920h31417H16H212H3(H3032)b2114
MFCD04227149
N#CC(=Cc1cn(c2c1cccc2)Cc1ccc(cc1)Cl)C(=O)Nc1ccc(c(c1)C)C
STK070746
ZINC000009635861
ZINC09635861
ZINC9635861
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