4-bromanyl-1-methyl-3-(3-methylphenyl)-5-phenylsulfanyl-pyridin-1-ium

Systemtic Name: 4-bromanyl-1-methyl-3-(3-methylphenyl)-5-phenylsulfanyl-pyridin-1-ium Openeye Name: 4-bromo-1-methyl-3-(m-tolyl)-5-phenylsulfanyl-pyridin-1-ium CAS Name: 4-bromo-1-methyl-3-(3-methylphenyl)-5-(phenylthio)pyridin-1-ium IUPAC Name: 4-bromo-1-methyl-3-(3-methylphenyl)-5-phenylsulfanylpyridin-1-ium Traditional Name: 4-bromo-1-methyl-3-(m-tolyl)-5-(phenylthio)pyridin-1-ium Formula: C19H17BrNS+ MolecularWeight: 371.31398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=C[N+](=CC(=C2Br)SC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=C[N+](=CC(=C2Br)SC3=CC=CC=C3)C

InChI

InChI=1S/C19H17BrNS/c1-14-7-6-8-15(11-14)17-12-21(2)13-18(19(17)20)22-16-9-4-3-5-10-16/h3-13H,1-2H3/q+1