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

Systemtic Name: 1-(4-methoxyphenyl)-2-(1-methyl-4,6-diphenyl-pyridin-1-ium-2-yl)sulfanyl-ethanone Openeye Name: 1-(4-methoxyphenyl)-2-(1-methyl-4,6-diphenyl-pyridin-1-ium-2-yl)sulfanyl-ethanone CAS Name: 1-(4-methoxyphenyl)-2-[(1-methyl-4,6-diphenyl-2-pyridin-1-iumyl)thio]ethanone IUPAC Name: 1-(4-methoxyphenyl)-2-(1-methyl-4,6-diphenylpyridin-1-ium-2-yl)sulfanylethanone Traditional Name: 1-(4-methoxyphenyl)-2-[(1-methyl-4,6-diphenyl-pyridin-1-ium-2-yl)thio]ethanone Formula: C27H24NO2S+ MolecularWeight: 426.54996

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H24NO2S/c1-28-25(21-11-7-4-8-12-21)17-23(20-9-5-3-6-10-20)18-27(28)31-19-26(29)22-13-15-24(30-2)16-14-22/h3-18H,19H2,1-2H3/q+1