methyl (Z)-2-cyano-4-[3-(dicyanomethylidene)-5,5-dimethyl-cyclohexen-1-yl]-3-methylsulfanyl-but-2-enoate

Systemtic Name: methyl (Z)-2-cyano-4-[3-(dicyanomethylidene)-5,5-dimethyl-cyclohexen-1-yl]-3-methylsulfanyl-but-2-enoate Openeye Name: methyl (Z)-2-cyano-4-[3-(dicyanomethylene)-5,5-dimethyl-cyclohexen-1-yl]-3-methylsulfanyl-but-2-enoate CAS Name: (Z)-2-cyano-4-[3-(dicyanomethylidene)-5,5-dimethyl-1-cyclohexenyl]-3-(methylthio)-2-butenoic acid methyl ester IUPAC Name: methyl (Z)-2-cyano-4-[3-(dicyanomethylidene)-5,5-dimethylcyclohexen-1-yl]-3-methylsulfanylbut-2-enoate Traditional Name: (Z)-2-cyano-4-[3-(dicyanomethylene)-5,5-dimethyl-cyclohexen-1-yl]-3-(methylthio)but-2-enoic acid methyl ester Formula: C18H19N3O2S MolecularWeight: 341.42736

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=C(C#N)C#N)C1)CC(=C(C#N)C(=O)OC)SC)C

Isomeric SMILES

CC1(CC(=CC(=C(C#N)C#N)C1)C/C(=C(\C#N)/C(=O)OC)/SC)C

InChI

InChI=1S/C18H19N3O2S/c1-18(2)7-12(5-13(8-18)14(9-19)10-20)6-16(24-4)15(11-21)17(22)23-3/h5H,6-8H2,1-4H3/b16-15-