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

Systemtic Name: [(4S)-5-cyano-4-(4-ethoxyphenyl)-6-methylsulfanyl-2-oxidanylidene-1,4-dihydropyridin-3-ylidene]-methoxy-methanolate Openeye Name: [(4S)-5-cyano-4-(4-ethoxyphenyl)-6-methylsulfanyl-2-oxo-1,4-dihydropyridin-3-ylidene]-methoxy-methanolate CAS Name: [(4S)-5-cyano-4-(4-ethoxyphenyl)-6-(methylthio)-2-oxo-1,4-dihydropyridin-3-ylidene]-methoxymethanolate IUPAC Name: [(4S)-5-cyano-4-(4-ethoxyphenyl)-6-methylsulfanyl-2-oxo-1,4-dihydropyridin-3-ylidene]-methoxymethanolate Traditional Name: [(4S)-5-cyano-2-keto-6-(methylthio)-4-p-phenetyl-1,4-dihydropyridin-3-ylidene]-methoxy-methanolate Formula: C17H17N2O4S- MolecularWeight: 345.39288

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2C(=C(NC(=O)C2=C([O-])OC)SC)C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)[C@@H]2C(=C(NC(=O)C2=C([O-])OC)SC)C#N

InChI

InChI=1S/C17H18N2O4S/c1-4-23-11-7-5-10(6-8-11)13-12(9-18)16(24-3)19-15(20)14(13)17(21)22-2/h5-8,13,21H,4H2,1-3H3,(H,19,20)/p-1/t13-/m1/s1