5-cyano-4-(2-ethoxyphenyl)-2-methyl-6-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-phenyl-1,4-dihydropyridine-3-carboxamide

Systemtic Name: 5-cyano-4-(2-ethoxyphenyl)-2-methyl-6-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-phenyl-1,4-dihydropyridine-3-carboxamide Openeye Name: 5-cyano-4-(2-ethoxyphenyl)-2-methyl-6-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-N-phenyl-1,4-dihydropyridine-3-carboxamide CAS Name: 5-cyano-4-(2-ethoxyphenyl)-2-methyl-6-[[2-(4-methylanilino)-2-oxoethyl]thio]-N-phenyl-1,4-dihydropyridine-3-carboxamide IUPAC Name: 5-cyano-4-(2-ethoxyphenyl)-2-methyl-6-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-N-phenyl-1,4-dihydropyridine-3-carboxamide Traditional Name: 5-cyano-6-[[2-keto-2-(p-toluidino)ethyl]thio]-2-methyl-4-o-phenetyl-N-phenyl-1,4-dihydropyridine-3-carboxamide Formula: C31H30N4O3S MolecularWeight: 538.6599

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2C(=C(NC(=C2C(=O)NC3=CC=CC=C3)C)SCC(=O)NC4=CC=C(C=C4)C)C#N

Isomeric SMILES

CCOC1=CC=CC=C1C2C(=C(NC(=C2C(=O)NC3=CC=CC=C3)C)SCC(=O)NC4=CC=C(C=C4)C)C#N

InChI

InChI=1S/C31H30N4O3S/c1-4-38-26-13-9-8-12-24(26)29-25(18-32)31(39-19-27(36)34-23-16-14-20(2)15-17-23)33-21(3)28(29)30(37)35-22-10-6-5-7-11-22/h5-17,29,33H,4,19H2,1-3H3,(H,34,36)(H,35,37)