methyl 5-cyano-4-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-6-sulfanyl-1H-pyridine-2-carboxylate

Systemtic Name: methyl 5-cyano-4-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-6-sulfanyl-1H-pyridine-2-carboxylate Openeye Name: methyl 5-cyano-4-(6-oxocyclohexa-2,4-dien-1-ylidene)-6-sulfanyl-1H-pyridine-2-carboxylate CAS Name: 5-cyano-6-mercapto-4-(6-oxo-1-cyclohexa-2,4-dienylidene)-1H-pyridine-2-carboxylic acid methyl ester IUPAC Name: methyl 5-cyano-4-(6-oxocyclohexa-2,4-dien-1-ylidene)-6-sulfanyl-1H-pyridine-2-carboxylate Traditional Name: 5-cyano-4-(6-ketocyclohexa-2,4-dien-1-ylidene)-6-mercapto-1H-pyridine-2-carboxylic acid methyl ester Formula: C14H10N2O3S MolecularWeight: 286.3058

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C2C=CC=CC2=O)C(=C(N1)S)C#N

Isomeric SMILES

COC(=O)C1=CC(=C2C=CC=CC2=O)C(=C(N1)S)C#N

InChI

InChI=1S/C14H10N2O3S/c1-19-14(18)11-6-9(10(7-15)13(20)16-11)8-4-2-3-5-12(8)17/h2-6,16,20H,1H3