Vitas-M small molecule compound
5-cyano-4-(2-ethoxyphenyl)-6-({2-[(3-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK887197
SMILES CCOc1ccccc1C1C(=C(SCC(=O)Nc2cccc(c2)OC)NC(=C1C(=O)Nc1ccccc1)C)C#N
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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/c1-4-39-26-16-9-8-15-24(26)29-25(18-32)31(40-19-27(36)34-22-13-10-14-23(17-22)38-3)33-20(2)28(29)30(37)35-21-11-6-5-7-12-21/h5-17,29,33H,4,19H2,1-3H3,(H,34,36)(H,35,37)InChIKey
XOODMURTEBRZDG-UHFFFAOYSA-NSynonyms
5cyano4(2ethoxyphenyl)6((2((3methoxyphenyl)amino)2oxoethyl)sulfanyl)2methylNphenyl14dihydropyridine3carboxamide
5cyano4(2ethoxyphenyl)6(2(3methoxyanilino)2oxoethyl)sulfanyl2methylNphenyl14dihydropyridine3carboxamide
CCOC1=CC=CC=C1C2C(=C(NC(=C2C(=O)NC3=CC=CC=C3)C)SCC(=O)NC4=CC(=CC=C4)OC)C#N
InChI=1SC31H30N4O4Sc14392616981524(26)2925(1832)31(401927(36)342213101423(1722)383)3320(2)28(29)30(37)3521116571221h5172933H419H213H3(H3436)(H3537)
MFCD10088024
ZINC000102809834
ZINC000102809835
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