methyl 5-cyano-6-[2-(diphenylamino)-2-oxidanylidene-ethyl]sulfanyl-4-(2-ethoxyphenyl)-2-methyl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: methyl 5-cyano-6-[2-(diphenylamino)-2-oxidanylidene-ethyl]sulfanyl-4-(2-ethoxyphenyl)-2-methyl-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl 5-cyano-4-(2-ethoxyphenyl)-2-methyl-6-[2-oxo-2-(N-phenylanilino)ethyl]sulfanyl-1,4-dihydropyridine-3-carboxylate CAS Name: 5-cyano-4-(2-ethoxyphenyl)-2-methyl-6-[[2-oxo-2-(N-phenylanilino)ethyl]thio]-1,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 5-cyano-4-(2-ethoxyphenyl)-2-methyl-6-[2-oxo-2-(N-phenylanilino)ethyl]sulfanyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-cyano-6-[[2-keto-2-(N-phenylanilino)ethyl]thio]-2-methyl-4-o-phenetyl-1,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C31H29N3O4S MolecularWeight: 539.64466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H29N3O4S/c1-4-38-26-18-12-11-17-24(26)29-25(19-32)30(33-21(2)28(29)31(36)37-3)39-20-27(35)34(22-13-7-5-8-14-22)23-15-9-6-10-16-23/h5-18,29,33H,4,20H2,1-3H3