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

Systemtic Name: [(4S)-4-(2-chlorophenyl)-5-cyano-6-methylsulfanyl-2-oxidanylidene-1,4-dihydropyridin-3-ylidene]-methoxy-methanolate Openeye Name: [(4S)-4-(2-chlorophenyl)-5-cyano-6-methylsulfanyl-2-oxo-1,4-dihydropyridin-3-ylidene]-methoxy-methanolate CAS Name: [(4S)-4-(2-chlorophenyl)-5-cyano-6-(methylthio)-2-oxo-1,4-dihydropyridin-3-ylidene]-methoxymethanolate IUPAC Name: [(4S)-4-(2-chlorophenyl)-5-cyano-6-methylsulfanyl-2-oxo-1,4-dihydropyridin-3-ylidene]-methoxymethanolate Traditional Name: [(4S)-4-(2-chlorophenyl)-5-cyano-2-keto-6-(methylthio)-1,4-dihydropyridin-3-ylidene]-methoxy-methanolate Formula: C15H12ClN2O3S- MolecularWeight: 335.78538

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Descriptors Computed from Structure

Canonical SMILES:

COC(=C1C(C(=C(NC1=O)SC)C#N)C2=CC=CC=C2Cl)[O-]

Isomeric SMILES

COC(=C1[C@@H](C(=C(NC1=O)SC)C#N)C2=CC=CC=C2Cl)[O-]

InChI

InChI=1S/C15H13ClN2O3S/c1-21-15(20)12-11(8-5-3-4-6-10(8)16)9(7-17)14(22-2)18-13(12)19/h3-6,11,20H,1-2H3,(H,18,19)/p-1/t11-/m1/s1