Vitas-M small molecule compound
6-({2-[(2-chlorophenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-4-(4-hydroxy-3-methoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK885929
SMILES N#CC1=C(SCC(=O)Nc2ccccc2Cl)NC(=C(C1c1ccc(c(c1)OC)O)C(=O)Nc1ccccc1)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 C29H25ClN4O4S MW 561.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25ClN4O4S/c1-17-26(28(37)33-19-8-4-3-5-9-19)27(18-12-13-23(35)24(14-18)38-2)20(15-31)29(32-17)39-16-25(36)34-22-11-7-6-10-21(22)30/h3-14,27,32,35H,16H2,1-2H3,(H,33,37)(H,34,36)InChIKey
RQANSUYEYXYHJZ-UHFFFAOYSA-NSynonyms
6((2((2chlorophenyl)amino)2oxoethyl)sulfanyl)5cyano4(4hydroxy3methoxyphenyl)2methylNphenyl14dihydropyridine3carboxamide
6(2(2chloroanilino)2oxoethyl)sulfanyl5cyano4(4hydroxy3methoxyphenyl)2methylNphenyl14dihydropyridine3carboxamide
CC1=C(C(C(=C(N1)SCC(=O)NC2=CC=CC=C2Cl)C#N)C3=CC(=C(C=C3)O)OC)C(=O)NC4=CC=CC=C4
InChI=1SC29H25ClN4O4Sc11726(28(37)33198435919)27(18121323(35)24(1418)382)20(1531)29(3217)391625(36)342211761021(22)30h314273235H16H212H3(H3337)(H3436)
MFCD10086479
ZINC000098048747
ZINC000098048748
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