[(4S)-5-cyano-6-methylsulfanyl-2-oxidanylidene-4-phenyl-1,4-dihydropyridin-3-ylidene]-methoxy-methanolate

Systemtic Name: [(4S)-5-cyano-6-methylsulfanyl-2-oxidanylidene-4-phenyl-1,4-dihydropyridin-3-ylidene]-methoxy-methanolate Openeye Name: [(4S)-5-cyano-6-methylsulfanyl-2-oxo-4-phenyl-1,4-dihydropyridin-3-ylidene]-methoxy-methanolate CAS Name: [(4S)-5-cyano-6-(methylthio)-2-oxo-4-phenyl-1,4-dihydropyridin-3-ylidene]-methoxymethanolate IUPAC Name: [(4S)-5-cyano-6-methylsulfanyl-2-oxo-4-phenyl-1,4-dihydropyridin-3-ylidene]-methoxymethanolate Traditional Name: [(4S)-5-cyano-2-keto-6-(methylthio)-4-phenyl-1,4-dihydropyridin-3-ylidene]-methoxy-methanolate Formula: C15H13N2O3S- MolecularWeight: 301.34032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC(=C1[C@@H](C(=C(NC1=O)SC)C#N)C2=CC=CC=C2)[O-]

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/h3-7,11,19H,1-2H3,(H,17,18)/p-1/t11-/m1/s1