2-[[(6S)-2-(dicyanomethyl)-4,4,6-trimethyl-cyclohexen-1-yl]-methylsulfanyl-methylidene]propanedinitrile

Systemtic Name: 2-[[(6S)-2-(dicyanomethyl)-4,4,6-trimethyl-cyclohexen-1-yl]-methylsulfanyl-methylidene]propanedinitrile Openeye Name: 2-[[(6S)-2-(dicyanomethyl)-4,4,6-trimethyl-cyclohexen-1-yl]-methylsulfanyl-methylene]propanedinitrile CAS Name: 2-[[(6S)-2-(dicyanomethyl)-4,4,6-trimethyl-1-cyclohexenyl]-(methylthio)methylidene]propanedinitrile IUPAC Name: 2-[[(6S)-2-(dicyanomethyl)-4,4,6-trimethylcyclohexen-1-yl]-methylsulfanylmethylidene]propanedinitrile Traditional Name: 2-[[(6S)-2-(dicyanomethyl)-4,4,6-trimethyl-cyclohexen-1-yl]-(methylthio)methylene]malononitrile Formula: C17H18N4S MolecularWeight: 310.41662

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(=C1C(=C(C#N)C#N)SC)C(C#N)C#N)(C)C

Isomeric SMILES

C[C@H]1CC(CC(=C1C(=C(C#N)C#N)SC)C(C#N)C#N)(C)C

InChI

InChI=1S/C17H18N4S/c1-11-5-17(2,3)6-14(12(7-18)8-19)15(11)16(22-4)13(9-20)10-21/h11-12H,5-6H2,1-4H3/t11-/m0/s1