ethyl 5-cyano-2-oxidanylidene-6-sulfanyl-1H-pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-2-oxidanylidene-6-sulfanyl-1H-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-2-oxo-6-sulfanyl-1H-pyridine-3-carboxylate CAS Name: 5-cyano-6-mercapto-2-oxo-1H-pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-2-oxo-6-sulfanyl-1H-pyridine-3-carboxylate Traditional Name: 5-cyano-2-keto-6-mercapto-1H-pyridine-3-carboxylic acid ethyl ester Formula: C9H8N2O3S MolecularWeight: 224.23642

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(NC1=O)S)C#N

Isomeric SMILES

CCOC(=O)C1=CC(=C(NC1=O)S)C#N

InChI

InChI=1S/C9H8N2O3S/c1-2-14-9(13)6-3-5(4-10)8(15)11-7(6)12/h3H,2H2,1H3,(H2,11,12,15)