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

Systemtic Name: ethyl 5-cyano-4-(furan-2-yl)-6-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-2-phenyl-1,4-dihydropyridine-3-carboxylate Openeye Name: ethyl 5-cyano-4-(2-furyl)-6-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-2-phenyl-1,4-dihydropyridine-3-carboxylate CAS Name: 5-cyano-4-(2-furanyl)-6-[[2-(4-methylanilino)-2-oxoethyl]thio]-2-phenyl-1,4-dihydropyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-4-(furan-2-yl)-6-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-2-phenyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-cyano-4-(2-furyl)-6-[[2-keto-2-(p-toluidino)ethyl]thio]-2-phenyl-1,4-dihydropyridine-3-carboxylic acid ethyl ester Formula: C28H25N3O4S MolecularWeight: 499.5808

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC=CO2)C#N)SCC(=O)NC3=CC=C(C=C3)C)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC=CO2)C#N)SCC(=O)NC3=CC=C(C=C3)C)C4=CC=CC=C4

InChI

InChI=1S/C28H25N3O4S/c1-3-34-28(33)25-24(22-10-7-15-35-22)21(16-29)27(31-26(25)19-8-5-4-6-9-19)36-17-23(32)30-20-13-11-18(2)12-14-20/h4-15,24,31H,3,17H2,1-2H3,(H,30,32)