Vitas-M small molecule compound
5-cyano-4-(2-ethoxyphenyl)-2-methyl-6-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-N-phenyl-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK764667
SMILES CCOc1ccccc1C1C(=C(SCC(=O)c2ccc(cc2)C)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 C31H29N3O3S MW 523.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29N3O3S/c1-4-37-27-13-9-8-12-24(27)29-25(18-32)31(38-19-26(35)22-16-14-20(2)15-17-22)33-21(3)28(29)30(36)34-23-10-6-5-7-11-23/h5-17,29,33H,4,19H2,1-3H3,(H,34,36)InChIKey
GCALHTWVJNSOJR-UHFFFAOYSA-NSynonyms
5cyano4(2ethoxyphenyl)2methyl6((2(4methylphenyl)2oxoethyl)sulfanyl)Nphenyl14dihydropyridine3carboxamide
5cyano4(2ethoxyphenyl)2methyl6((2oxo2(ptolyl)ethyl)thio)Nphenyl14dihydropyridine3carboxamide
5CYANO4(2ETHOXYPHENYL)2METHYL6(2(4METHYLPHENYL)2OXOETHYL)SULFANYLNPHENYL14DIHYDROPYRIDINE3CARBOXAMIDE
CCOC1=CC=CC=C1C2C(=C(NC(=C2C(=O)NC3=CC=CC=C3)C)SCC(=O)C4=CC=C(C=C4)C)C#N
InChI=1SC31H29N3O3Sc14372713981224(27)2925(1832)31(381926(35)22161420(2)151722)3321(3)28(29)30(36)3423106571123h5172933H419H213H3(H3436)
MFCD02233519
ZINC000019939557
ZINC000019939559
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