(4-bromophenyl)-[2-(4-methylphenyl)sulfanylquinolin-1-ium-1-yl]azanide

Systemtic Name: (4-bromophenyl)-[2-(4-methylphenyl)sulfanylquinolin-1-ium-1-yl]azanide Openeye Name: (4-bromophenyl)-[2-(p-tolylsulfanyl)quinolin-1-ium-1-yl]azanide CAS Name: (4-bromophenyl)-[2-[(4-methylphenyl)thio]-1-quinolin-1-iumyl]azanide IUPAC Name: (4-bromophenyl)-[2-(4-methylphenyl)sulfanylquinolin-1-ium-1-yl]azanide Traditional Name: (4-bromophenyl)-[2-(p-tolylthio)quinolin-1-ium-1-yl]azanide Formula: C22H17BrN2S MolecularWeight: 421.35278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=[N+](C3=CC=CC=C3C=C2)[N-]C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC=C(C=C1)SC2=[N+](C3=CC=CC=C3C=C2)[N-]C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H17BrN2S/c1-16-6-13-20(14-7-16)26-22-15-8-17-4-2-3-5-21(17)25(22)24-19-11-9-18(23)10-12-19/h2-15H,1H3