1-(4-bromophenyl)-2-(1-methyl-4,6-diphenyl-pyridin-1-ium-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(4-bromophenyl)-2-(1-methyl-4,6-diphenyl-pyridin-1-ium-2-yl)sulfanyl-ethanone Openeye Name: 1-(4-bromophenyl)-2-(1-methyl-4,6-diphenyl-pyridin-1-ium-2-yl)sulfanyl-ethanone CAS Name: 1-(4-bromophenyl)-2-[(1-methyl-4,6-diphenyl-2-pyridin-1-iumyl)thio]ethanone IUPAC Name: 1-(4-bromophenyl)-2-(1-methyl-4,6-diphenylpyridin-1-ium-2-yl)sulfanylethanone Traditional Name: 1-(4-bromophenyl)-2-[(1-methyl-4,6-diphenyl-pyridin-1-ium-2-yl)thio]ethanone Formula: C26H21BrNOS+ MolecularWeight: 475.42004

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C=C(C=C1SCC(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C[N+]1=C(C=C(C=C1SCC(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H21BrNOS/c1-28-24(20-10-6-3-7-11-20)16-22(19-8-4-2-5-9-19)17-26(28)30-18-25(29)21-12-14-23(27)15-13-21/h2-17H,18H2,1H3/q+1