N-(3-ethanoylphenyl)-2-[[3-(phenylsulfonyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(3-ethanoylphenyl)-2-[[3-(phenylsulfonyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl]ethanamide Openeye Name: N-(3-acetylphenyl)-2-[[3-(benzenesulfonyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl]acetamide CAS Name: N-(3-acetylphenyl)-2-[[3-(benzenesulfonyl)-1H-benzimidazol-3-ium-2-yl]thio]acetamide IUPAC Name: N-(3-acetylphenyl)-2-[[3-(benzenesulfonyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl]acetamide Traditional Name: N-(3-acetylphenyl)-2-[(3-besyl-1H-benzimidazol-3-ium-2-yl)thio]acetamide Formula: C23H20N3O4S2+ MolecularWeight: 466.5526

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)CSC2=[N+](C3=CC=CC=C3N2)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)CSC2=[N+](C3=CC=CC=C3N2)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H19N3O4S2/c1-16(27)17-8-7-9-18(14-17)24-22(28)15-31-23-25-20-12-5-6-13-21(20)26(23)32(29,30)19-10-3-2-4-11-19/h2-14H,15H2,1H3,(H,24,28)/p+1