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

Systemtic Name: 2-methoxyethyl 4-(4-chlorophenyl)-5-cyano-6-[2-(diphenylamino)-2-oxidanylidene-ethyl]sulfanyl-2-methyl-1,4-dihydropyridine-3-carboxylate Openeye Name: 2-methoxyethyl 4-(4-chlorophenyl)-5-cyano-2-methyl-6-[2-oxo-2-(N-phenylanilino)ethyl]sulfanyl-1,4-dihydropyridine-3-carboxylate CAS Name: 4-(4-chlorophenyl)-5-cyano-2-methyl-6-[[2-oxo-2-(N-phenylanilino)ethyl]thio]-1,4-dihydropyridine-3-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 4-(4-chlorophenyl)-5-cyano-2-methyl-6-[2-oxo-2-(N-phenylanilino)ethyl]sulfanyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-5-cyano-6-[[2-keto-2-(N-phenylanilino)ethyl]thio]-2-methyl-1,4-dihydropyridine-3-carboxylic acid 2-methoxyethyl ester Formula: C31H28ClN3O4S MolecularWeight: 574.08972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC(=O)N(C2=CC=CC=C2)C3=CC=CC=C3)C#N)C4=CC=C(C=C4)Cl)C(=O)OCCOC

Isomeric SMILES

CC1=C(C(C(=C(N1)SCC(=O)N(C2=CC=CC=C2)C3=CC=CC=C3)C#N)C4=CC=C(C=C4)Cl)C(=O)OCCOC

InChI

InChI=1S/C31H28ClN3O4S/c1-21-28(31(37)39-18-17-38-2)29(22-13-15-23(32)16-14-22)26(19-33)30(34-21)40-20-27(36)35(24-9-5-3-6-10-24)25-11-7-4-8-12-25/h3-16,29,34H,17-18,20H2,1-2H3