[(1E)-4,4-dicyano-3-(4-methylphenyl)-1-methylsulfanyl-buta-1,3-dienyl]-trimethyl-azanium

Systemtic Name: [(1E)-4,4-dicyano-3-(4-methylphenyl)-1-methylsulfanyl-buta-1,3-dienyl]-trimethyl-azanium Openeye Name: [(1E)-4,4-dicyano-1-methylsulfanyl-3-(p-tolyl)buta-1,3-dienyl]-trimethyl-ammonium CAS Name: [(1E)-4,4-dicyano-3-(4-methylphenyl)-1-(methylthio)buta-1,3-dienyl]-trimethylammonium IUPAC Name: [(1E)-4,4-dicyano-3-(4-methylphenyl)-1-methylsulfanylbuta-1,3-dienyl]-trimethylazanium Traditional Name: [(1E)-4,4-dicyano-1-(methylthio)-3-(p-tolyl)buta-1,3-dienyl]-trimethyl-ammonium Formula: C17H20N3S+ MolecularWeight: 298.4258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=C(C#N)C#N)C=C([N+](C)(C)C)SC

Isomeric SMILES

CC1=CC=C(C=C1)C(=C(C#N)C#N)/C=C(\[N+](C)(C)C)/SC

InChI

InChI=1S/C17H20N3S/c1-13-6-8-14(9-7-13)16(15(11-18)12-19)10-17(21-5)20(2,3)4/h6-10H,1-5H3/q+1/b17-10+