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

Systemtic Name: methyl 5-cyano-4-(2-fluorophenyl)-6-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-2-oxidanylidene-3,4-dihydro-1H-pyridine-3-carboxylate Openeye Name: methyl 5-cyano-4-(2-fluorophenyl)-6-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-2-oxo-3,4-dihydro-1H-pyridine-3-carboxylate CAS Name: 5-cyano-4-(2-fluorophenyl)-6-[[2-(4-methylanilino)-2-oxoethyl]thio]-2-oxo-3,4-dihydro-1H-pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 5-cyano-4-(2-fluorophenyl)-6-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-2-oxo-3,4-dihydro-1H-pyridine-3-carboxylate Traditional Name: 5-cyano-4-(2-fluorophenyl)-2-keto-6-[[2-keto-2-(p-toluidino)ethyl]thio]-3,4-dihydro-1H-pyridine-3-carboxylic acid methyl ester Formula: C23H20FN3O4S MolecularWeight: 453.486003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSC2=C(C(C(C(=O)N2)C(=O)OC)C3=CC=CC=C3F)C#N

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSC2=C(C(C(C(=O)N2)C(=O)OC)C3=CC=CC=C3F)C#N

InChI

InChI=1S/C23H20FN3O4S/c1-13-7-9-14(10-8-13)26-18(28)12-32-22-16(11-25)19(15-5-3-4-6-17(15)24)20(21(29)27-22)23(30)31-2/h3-10,19-20H,12H2,1-2H3,(H,26,28)(H,27,29)