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

Systemtic Name: methyl 5-cyano-6-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-2-oxidanylidene-4-(4-propan-2-ylphenyl)-3,4-dihydro-1H-pyridine-3-carboxylate Openeye Name: methyl 5-cyano-4-(4-isopropylphenyl)-6-[2-(2-methylanilino)-2-oxo-ethyl]sulfanyl-2-oxo-3,4-dihydro-1H-pyridine-3-carboxylate CAS Name: 5-cyano-6-[[2-(2-methylanilino)-2-oxoethyl]thio]-2-oxo-4-(4-propan-2-ylphenyl)-3,4-dihydro-1H-pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 5-cyano-6-[2-(2-methylanilino)-2-oxoethyl]sulfanyl-2-oxo-4-(4-propan-2-ylphenyl)-3,4-dihydro-1H-pyridine-3-carboxylate Traditional Name: 5-cyano-2-keto-6-[[2-keto-2-(o-toluidino)ethyl]thio]-4-p-cumenyl-3,4-dihydro-1H-pyridine-3-carboxylic acid methyl ester Formula: C26H27N3O4S MolecularWeight: 477.57528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CSC2=C(C(C(C(=O)N2)C(=O)OC)C3=CC=C(C=C3)C(C)C)C#N

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CSC2=C(C(C(C(=O)N2)C(=O)OC)C3=CC=C(C=C3)C(C)C)C#N

InChI

InChI=1S/C26H27N3O4S/c1-15(2)17-9-11-18(12-10-17)22-19(13-27)25(29-24(31)23(22)26(32)33-4)34-14-21(30)28-20-8-6-5-7-16(20)3/h5-12,15,22-23H,14H2,1-4H3,(H,28,30)(H,29,31)