ethyl 4-(2-chlorophenyl)-5-cyano-6-[2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl]sulfanyl-2-phenyl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: ethyl 4-(2-chlorophenyl)-5-cyano-6-[2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl]sulfanyl-2-phenyl-1,4-dihydropyridine-3-carboxylate Openeye Name: ethyl 4-(2-chlorophenyl)-5-cyano-6-[2-(1-naphthylamino)-2-oxo-ethyl]sulfanyl-2-phenyl-1,4-dihydropyridine-3-carboxylate CAS Name: 4-(2-chlorophenyl)-5-cyano-6-[[2-(1-naphthalenylamino)-2-oxoethyl]thio]-2-phenyl-1,4-dihydropyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-chlorophenyl)-5-cyano-6-[2-(naphthalen-1-ylamino)-2-oxoethyl]sulfanyl-2-phenyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 4-(2-chlorophenyl)-5-cyano-6-[[2-keto-2-(1-naphthylamino)ethyl]thio]-2-phenyl-1,4-dihydropyridine-3-carboxylic acid ethyl ester Formula: C33H26ClN3O3S MolecularWeight: 580.09584

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2Cl)C#N)SCC(=O)NC3=CC=CC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2Cl)C#N)SCC(=O)NC3=CC=CC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C33H26ClN3O3S/c1-2-40-33(39)30-29(24-16-8-9-17-26(24)34)25(19-35)32(37-31(30)22-12-4-3-5-13-22)41-20-28(38)36-27-18-10-14-21-11-6-7-15-23(21)27/h3-18,29,37H,2,20H2,1H3,(H,36,38)