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

Systemtic Name: [(1E)-4,4-dicyano-1-methylsulfanyl-3-phenyl-buta-1,3-dienyl]-trimethyl-azanium Openeye Name: [(1E)-4,4-dicyano-1-methylsulfanyl-3-phenyl-buta-1,3-dienyl]-trimethyl-ammonium CAS Name: [(1E)-4,4-dicyano-1-(methylthio)-3-phenylbuta-1,3-dienyl]-trimethylammonium IUPAC Name: [(1E)-4,4-dicyano-1-methylsulfanyl-3-phenylbuta-1,3-dienyl]-trimethylazanium Traditional Name: [(1E)-4,4-dicyano-1-(methylthio)-3-phenyl-buta-1,3-dienyl]-trimethyl-ammonium Formula: C16H18N3S+ MolecularWeight: 284.39922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N3S/c1-19(2,3)16(20-4)10-15(14(11-17)12-18)13-8-6-5-7-9-13/h5-10H,1-4H3/q+1/b16-10+