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

Systemtic Name: [(4R)-4-(4-chlorophenyl)-5-cyano-6-ethylsulfanyl-2-oxidanylidene-1,4-dihydropyridin-3-ylidene]-methoxy-methanolate Openeye Name: [(4R)-4-(4-chlorophenyl)-5-cyano-6-ethylsulfanyl-2-oxo-1,4-dihydropyridin-3-ylidene]-methoxy-methanolate CAS Name: [(4R)-4-(4-chlorophenyl)-5-cyano-6-(ethylthio)-2-oxo-1,4-dihydropyridin-3-ylidene]-methoxymethanolate IUPAC Name: [(4R)-4-(4-chlorophenyl)-5-cyano-6-ethylsulfanyl-2-oxo-1,4-dihydropyridin-3-ylidene]-methoxymethanolate Traditional Name: [(4R)-4-(4-chlorophenyl)-5-cyano-6-(ethylthio)-2-keto-1,4-dihydropyridin-3-ylidene]-methoxy-methanolate Formula: C16H14ClN2O3S- MolecularWeight: 349.81196

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C(C(=C([O-])OC)C(=O)N1)C2=CC=C(C=C2)Cl)C#N

Isomeric SMILES

CCSC1=C([C@@H](C(=C([O-])OC)C(=O)N1)C2=CC=C(C=C2)Cl)C#N

InChI

InChI=1S/C16H15ClN2O3S/c1-3-23-15-11(8-18)12(9-4-6-10(17)7-5-9)13(14(20)19-15)16(21)22-2/h4-7,12,21H,3H2,1-2H3,(H,19,20)/p-1/t12-/m0/s1