methyl (5Z)-3,3-dicyano-5-[methoxy(oxidanyl)methylidene]-4-(4-methylsulfanylphenyl)-6-oxidanylidene-2-pyridin-4-yl-cyclohexane-1-carboxylate

Systemtic Name: methyl (5Z)-3,3-dicyano-5-[methoxy(oxidanyl)methylidene]-4-(4-methylsulfanylphenyl)-6-oxidanylidene-2-pyridin-4-yl-cyclohexane-1-carboxylate Openeye Name: methyl (5Z)-3,3-dicyano-5-[hydroxy(methoxy)methylene]-4-(4-methylsulfanylphenyl)-6-oxo-2-(4-pyridyl)cyclohexanecarboxylate CAS Name: (5Z)-3,3-dicyano-5-[hydroxy(methoxy)methylidene]-4-[4-(methylthio)phenyl]-6-oxo-2-pyridin-4-yl-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (5Z)-3,3-dicyano-5-[hydroxy(methoxy)methylidene]-4-(4-methylsulfanylphenyl)-6-oxo-2-pyridin-4-ylcyclohexane-1-carboxylate Traditional Name: (5Z)-3,3-dicyano-5-[hydroxy(methoxy)methylene]-6-keto-4-[4-(methylthio)phenyl]-2-(4-pyridyl)cyclohexanecarboxylic acid methyl ester Formula: C24H21N3O5S MolecularWeight: 463.50564

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(C(C(C(=C(O)OC)C1=O)C2=CC=C(C=C2)SC)(C#N)C#N)C3=CC=NC=C3

Isomeric SMILES

COC(=O)C1C(C(C(/C(=C(\O)/OC)/C1=O)C2=CC=C(C=C2)SC)(C#N)C#N)C3=CC=NC=C3

InChI

InChI=1S/C24H21N3O5S/c1-31-22(29)17-19(14-4-6-16(33-3)7-5-14)24(12-25,13-26)20(15-8-10-27-11-9-15)18(21(17)28)23(30)32-2/h4-11,18-20,29H,1-3H3/b22-17-