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

Systemtic Name: methyl 5-cyano-4-(2-ethoxyphenyl)-6-[2-[(3-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-2-methyl-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl 5-cyano-6-[2-(3-ethoxyanilino)-2-oxo-ethyl]sulfanyl-4-(2-ethoxyphenyl)-2-methyl-1,4-dihydropyridine-3-carboxylate CAS Name: 5-cyano-6-[[2-(3-ethoxyanilino)-2-oxoethyl]thio]-4-(2-ethoxyphenyl)-2-methyl-1,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 5-cyano-6-[2-(3-ethoxyanilino)-2-oxoethyl]sulfanyl-4-(2-ethoxyphenyl)-2-methyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-cyano-6-[[2-keto-2-(m-phenetidino)ethyl]thio]-2-methyl-4-o-phenetyl-1,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C27H29N3O5S MolecularWeight: 507.60126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)OC)C3=CC=CC=C3OCC)C#N

Isomeric SMILES

CCOC1=CC=CC(=C1)NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)OC)C3=CC=CC=C3OCC)C#N

InChI

InChI=1S/C27H29N3O5S/c1-5-34-19-11-9-10-18(14-19)30-23(31)16-36-26-21(15-28)25(24(17(3)29-26)27(32)33-4)20-12-7-8-13-22(20)35-6-2/h7-14,25,29H,5-6,16H2,1-4H3,(H,30,31)