Vitas-M small molecule compound
5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-({2-[(2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-N-phenyl-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK553310
SMILES CCOc1ccc(cc1)C1C(=C(SCC(=O)Nc2ccccc2C)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 C31H30N4O3S MW 538.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30N4O3S/c1-4-38-24-16-14-22(15-17-24)29-25(18-32)31(39-19-27(36)35-26-13-9-8-10-20(26)2)33-21(3)28(29)30(37)34-23-11-6-5-7-12-23/h5-17,29,33H,4,19H2,1-3H3,(H,34,37)(H,35,36)InChIKey
PHVKYNRSCWUUEJ-UHFFFAOYSA-NSynonyms
684231-30-95cyano4(4ethoxyphenyl)2methyl6((2((2methylphenyl)amino)2oxoethyl)sulfanyl)Nphenyl14dihydropyridine3carboxamide
5cyano4(4ethoxyphenyl)2methyl6((2oxo2(otolylamino)ethyl)thio)Nphenyl14dihydropyridine3carboxamide
5CYANO4(4ETHOXYPHENYL)2METHYL6(2(2METHYLANILINO)2OXOETHYL)SULFANYLNPHENYL14DIHYDROPYRIDINE3CARBOXAMIDE
684231309
CCOC1=CC=C(C=C1)C2C(=C(NC(=C2C(=O)NC3=CC=CC=C3)C)SCC(=O)NC4=CC=CC=C4C)C#N
InChI=1SC31H30N4O3Sc143824161422(151724)2925(1832)31(391927(36)352613981020(26)2)3321(3)28(29)30(37)3423116571223h5172933H419H213H3(H3437)(H3536)
MFCD03680912
ZINC000097952089
ZINC000097952090
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