ethyl 5-cyano-6-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-(4-methylphenyl)-2-phenyl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-6-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-(4-methylphenyl)-2-phenyl-1,4-dihydropyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-[2-(2-ethylanilino)-2-oxo-ethyl]sulfanyl-2-phenyl-4-(p-tolyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 5-cyano-6-[[2-(2-ethylanilino)-2-oxoethyl]thio]-4-(4-methylphenyl)-2-phenyl-1,4-dihydropyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-[2-(2-ethylanilino)-2-oxoethyl]sulfanyl-4-(4-methylphenyl)-2-phenyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-cyano-6-[[2-(2-ethylanilino)-2-keto-ethyl]thio]-2-phenyl-4-(p-tolyl)-1,4-dihydropyridine-3-carboxylic acid ethyl ester Formula: C32H31N3O3S MolecularWeight: 537.67184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CSC2=C(C(C(=C(N2)C3=CC=CC=C3)C(=O)OCC)C4=CC=C(C=C4)C)C#N

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CSC2=C(C(C(=C(N2)C3=CC=CC=C3)C(=O)OCC)C4=CC=C(C=C4)C)C#N

InChI

InChI=1S/C32H31N3O3S/c1-4-22-11-9-10-14-26(22)34-27(36)20-39-31-25(19-33)28(23-17-15-21(3)16-18-23)29(32(37)38-5-2)30(35-31)24-12-7-6-8-13-24/h6-18,28,35H,4-5,20H2,1-3H3,(H,34,36)