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

Systemtic Name: [(4S)-5-cyano-2-oxidanylidene-4-phenyl-6-prop-2-enylsulfanyl-1,4-dihydropyridin-3-ylidene]-methoxy-methanolate Openeye Name: [(4S)-6-allylsulfanyl-5-cyano-2-oxo-4-phenyl-1,4-dihydropyridin-3-ylidene]-methoxy-methanolate CAS Name: [(4S)-5-cyano-2-oxo-4-phenyl-6-(prop-2-enylthio)-1,4-dihydropyridin-3-ylidene]-methoxymethanolate IUPAC Name: [(4S)-5-cyano-2-oxo-4-phenyl-6-prop-2-enylsulfanyl-1,4-dihydropyridin-3-ylidene]-methoxymethanolate Traditional Name: [(4S)-6-(allylthio)-5-cyano-2-keto-4-phenyl-1,4-dihydropyridin-3-ylidene]-methoxy-methanolate Formula: C17H15N2O3S- MolecularWeight: 327.3776

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O3S/c1-3-9-23-16-12(10-18)13(11-7-5-4-6-8-11)14(15(20)19-16)17(21)22-2/h3-8,13,21H,1,9H2,2H3,(H,19,20)/p-1/t13-/m1/s1