methyl 5-cyano-4-(4-methylphenyl)-2-oxidanylidene-6-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfanyl-3,4-dihydro-1H-pyridine-3-carboxylate

Systemtic Name: methyl 5-cyano-4-(4-methylphenyl)-2-oxidanylidene-6-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfanyl-3,4-dihydro-1H-pyridine-3-carboxylate Openeye Name: methyl 6-[2-(benzylamino)-2-oxo-ethyl]sulfanyl-5-cyano-2-oxo-4-(p-tolyl)-3,4-dihydro-1H-pyridine-3-carboxylate CAS Name: 5-cyano-4-(4-methylphenyl)-2-oxo-6-[[2-oxo-2-[(phenylmethyl)amino]ethyl]thio]-3,4-dihydro-1H-pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 6-[2-(benzylamino)-2-oxoethyl]sulfanyl-5-cyano-4-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridine-3-carboxylate Traditional Name: 6-[[2-(benzylamino)-2-keto-ethyl]thio]-5-cyano-2-keto-4-(p-tolyl)-3,4-dihydro-1H-pyridine-3-carboxylic acid methyl ester Formula: C24H23N3O4S MolecularWeight: 449.52212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(C(=O)NC(=C2C#N)SCC(=O)NCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2C(C(=O)NC(=C2C#N)SCC(=O)NCC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C24H23N3O4S/c1-15-8-10-17(11-9-15)20-18(12-25)23(27-22(29)21(20)24(30)31-2)32-14-19(28)26-13-16-6-4-3-5-7-16/h3-11,20-21H,13-14H2,1-2H3,(H,26,28)(H,27,29)