1-(4-bromophenyl)-4-(4-methylphenyl)-2-methylsulfanyl-pyrimidin-1-ium

Systemtic Name: 1-(4-bromophenyl)-4-(4-methylphenyl)-2-methylsulfanyl-pyrimidin-1-ium Openeye Name: 1-(4-bromophenyl)-2-methylsulfanyl-4-(p-tolyl)pyrimidin-1-ium CAS Name: 1-(4-bromophenyl)-4-(4-methylphenyl)-2-(methylthio)pyrimidin-1-ium IUPAC Name: 1-(4-bromophenyl)-4-(4-methylphenyl)-2-methylsulfanylpyrimidin-1-ium Traditional Name: 1-(4-bromophenyl)-2-(methylthio)-4-(p-tolyl)pyrimidin-1-ium Formula: C18H16BrN2S+ MolecularWeight: 372.30204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=[N+](C=C2)C3=CC=C(C=C3)Br)SC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=[N+](C=C2)C3=CC=C(C=C3)Br)SC

InChI

InChI=1S/C18H16BrN2S/c1-13-3-5-14(6-4-13)17-11-12-21(18(20-17)22-2)16-9-7-15(19)8-10-16/h3-12H,1-2H3/q+1