ethyl 5-cyano-4-methylsulfanyl-6-oxidanylidene-2-phenyl-1H-pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-4-methylsulfanyl-6-oxidanylidene-2-phenyl-1H-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-4-methylsulfanyl-6-oxo-2-phenyl-1H-pyridine-3-carboxylate CAS Name: 5-cyano-4-(methylthio)-6-oxo-2-phenyl-1H-pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-4-methylsulfanyl-6-oxo-2-phenyl-1H-pyridine-3-carboxylate Traditional Name: 5-cyano-6-keto-4-(methylthio)-2-phenyl-1H-pyridine-3-carboxylic acid ethyl ester Formula: C16H14N2O3S MolecularWeight: 314.35896

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)C(=C1SC)C#N)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)C(=C1SC)C#N)C2=CC=CC=C2

InChI

InChI=1S/C16H14N2O3S/c1-3-21-16(20)12-13(10-7-5-4-6-8-10)18-15(19)11(9-17)14(12)22-2/h4-8H,3H2,1-2H3,(H,18,19)