Vitas-M small molecule compound
5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-6-({2-[(2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-N-phenyl-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK886683
SMILES N#CC1=C(SCC(=O)Nc2ccccc2C)NC(=C(C1c1ccc(c(c1)OC)OC)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 C31H30N4O4S MW 554.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30N4O4S/c1-19-10-8-9-13-24(19)35-27(36)18-40-31-23(17-32)29(21-14-15-25(38-3)26(16-21)39-4)28(20(2)33-31)30(37)34-22-11-6-5-7-12-22/h5-16,29,33H,18H2,1-4H3,(H,34,37)(H,35,36)InChIKey
ZKVRFVUDIHRGRO-UHFFFAOYSA-NSynonyms
5cyano4(34dimethoxyphenyl)2methyl6((2((2methylphenyl)amino)2oxoethyl)sulfanyl)Nphenyl14dihydropyridine3carboxamide
5cyano4(34dimethoxyphenyl)2methyl6(2(2methylanilino)2oxoethyl)sulfanylNphenyl14dihydropyridine3carboxamide
CC1=CC=CC=C1NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=CC=C3)C4=CC(=C(C=C4)OC)OC)C#N
InChI=1SC31H30N4O4Sc11910891324(19)3527(36)18403123(1732)29(21141525(383)26(1621)394)28(20(2)3331)30(37)3422116571222h5162933H18H214H3(H3437)(H3536)
MFCD10087212
ZINC000102809355
ZINC000102809357
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