methyl 5-cyano-6-[2-[(3-ethanoylphenyl)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-[(3-ethanoylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-2-oxidanylidene-4-(4-propan-2-ylphenyl)-3,4-dihydro-1H-pyridine-3-carboxylate Openeye Name: methyl 6-[2-(3-acetylanilino)-2-oxo-ethyl]sulfanyl-5-cyano-4-(4-isopropylphenyl)-2-oxo-3,4-dihydro-1H-pyridine-3-carboxylate CAS Name: 6-[[2-(3-acetylanilino)-2-oxoethyl]thio]-5-cyano-2-oxo-4-(4-propan-2-ylphenyl)-3,4-dihydro-1H-pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 6-[2-(3-acetylanilino)-2-oxoethyl]sulfanyl-5-cyano-2-oxo-4-(4-propan-2-ylphenyl)-3,4-dihydro-1H-pyridine-3-carboxylate Traditional Name: 6-[[2-(3-acetylanilino)-2-keto-ethyl]thio]-5-cyano-2-keto-4-p-cumenyl-3,4-dihydro-1H-pyridine-3-carboxylic acid methyl ester Formula: C27H27N3O5S MolecularWeight: 505.58538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2C(C(=O)NC(=C2C#N)SCC(=O)NC3=CC=CC(=C3)C(=O)C)C(=O)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2C(C(=O)NC(=C2C#N)SCC(=O)NC3=CC=CC(=C3)C(=O)C)C(=O)OC

InChI

InChI=1S/C27H27N3O5S/c1-15(2)17-8-10-18(11-9-17)23-21(13-28)26(30-25(33)24(23)27(34)35-4)36-14-22(32)29-20-7-5-6-19(12-20)16(3)31/h5-12,15,23-24H,14H2,1-4H3,(H,29,32)(H,30,33)