6-[(2-ethyl-6-methyl-phenyl)amino]-9-(4-methylphenyl)-9-aza-7-azoniaspiro[4.4]non-6-ene-8-thione

Systemtic Name: 6-[(2-ethyl-6-methyl-phenyl)amino]-9-(4-methylphenyl)-9-aza-7-azoniaspiro[4.4]non-6-ene-8-thione Openeye Name: 6-(2-ethyl-6-methyl-anilino)-9-(p-tolyl)-9-aza-7-azoniaspiro[4.4]non-6-ene-8-thione CAS Name: 6-(2-ethyl-6-methylanilino)-9-(4-methylphenyl)-9-aza-7-azoniaspiro[4.4]non-6-ene-8-thione IUPAC Name: 6-(2-ethyl-6-methylanilino)-9-(4-methylphenyl)-9-aza-7-azoniaspiro[4.4]non-6-ene-8-thione Traditional Name: 6-(2-ethyl-6-methyl-anilino)-9-(p-tolyl)-9-aza-7-azoniaspiro[4.4]non-6-ene-8-thione Formula: C23H28N3S+ MolecularWeight: 378.55352

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC2=[NH+]C(=S)N(C23CCCC3)C4=CC=C(C=C4)C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC2=[NH+]C(=S)N(C23CCCC3)C4=CC=C(C=C4)C)C

InChI

InChI=1S/C23H27N3S/c1-4-18-9-7-8-17(3)20(18)24-21-23(14-5-6-15-23)26(22(27)25-21)19-12-10-16(2)11-13-19/h7-13H,4-6,14-15H2,1-3H3,(H,24,25,27)/p+1