(4-methyl-2-methylsulfanyl-imidazol-2-yl)methyl-triphenyl-phosphanium bromide

Systemtic Name: (4-methyl-2-methylsulfanyl-imidazol-2-yl)methyl-triphenyl-phosphanium bromide Openeye Name: (4-methyl-2-methylsulfanyl-imidazol-2-yl)methyl-triphenyl-phosphonium bromide CAS Name: [4-methyl-2-(methylthio)-2-imidazolyl]methyl-triphenylphosphonium bromide IUPAC Name: (4-methyl-2-methylsulfanylimidazol-2-yl)methyl-triphenylphosphanium bromide Traditional Name: [4-methyl-2-(methylthio)imidazol-2-yl]methyl-triphenyl-phosphonium bromide Formula: C24H24BrN2PS MolecularWeight: 483.403521

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(N=C1)(C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)SC.[Br-]

Isomeric SMILES

CC1=NC(N=C1)(C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)SC.[Br-]

InChI

InChI=1S/C24H24N2PS.BrH/c1-20-18-25-24(26-20,28-2)19-27(21-12-6-3-7-13-21,22-14-8-4-9-15-22)23-16-10-5-11-17-23;/h3-18H,19H2,1-2H3;1H/q+1;/p-1