methyl (3R,4R)-5-cyano-6-methylsulfanyl-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyridine-3-carboxylate

Systemtic Name: methyl (3R,4R)-5-cyano-6-methylsulfanyl-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyridine-3-carboxylate Openeye Name: methyl (3R,4R)-5-cyano-6-methylsulfanyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyridine-3-carboxylate CAS Name: (3R,4R)-5-cyano-6-(methylthio)-2-oxo-4-phenyl-3,4-dihydro-1H-pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl (3R,4R)-5-cyano-6-methylsulfanyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyridine-3-carboxylate Traditional Name: (3R,4R)-5-cyano-2-keto-6-(methylthio)-4-phenyl-3,4-dihydro-1H-pyridine-3-carboxylic acid methyl ester Formula: C15H14N2O3S MolecularWeight: 302.34826

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(C(=C(NC1=O)SC)C#N)C2=CC=CC=C2

Isomeric SMILES

COC(=O)[C@@H]1[C@@H](C(=C(NC1=O)SC)C#N)C2=CC=CC=C2

InChI

InChI=1S/C15H14N2O3S/c1-20-15(19)12-11(9-6-4-3-5-7-9)10(8-16)14(21-2)17-13(12)18/h3-7,11-12H,1-2H3,(H,17,18)/t11-,12-/m1/s1