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

Systemtic Name: N-[2-(phenylcarbonyl)phenyl]-2-[[3-(phenylsulfonyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl]ethanamide Openeye Name: 2-[[3-(benzenesulfonyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl]-N-(2-benzoylphenyl)acetamide CAS Name: 2-[[3-(benzenesulfonyl)-1H-benzimidazol-3-ium-2-yl]thio]-N-(2-benzoylphenyl)acetamide IUPAC Name: 2-[[3-(benzenesulfonyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl]-N-(2-benzoylphenyl)acetamide Traditional Name: N-(2-benzoylphenyl)-2-[(3-besyl-1H-benzimidazol-3-ium-2-yl)thio]acetamide Formula: C28H22N3O4S2+ MolecularWeight: 528.62198

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC=CC=C2NC(=O)CSC3=[N+](C4=CC=CC=C4N3)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC=CC=C2NC(=O)CSC3=[N+](C4=CC=CC=C4N3)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H21N3O4S2/c32-26(29-23-16-8-7-15-22(23)27(33)20-11-3-1-4-12-20)19-36-28-30-24-17-9-10-18-25(24)31(28)37(34,35)21-13-5-2-6-14-21/h1-18H,19H2,(H,29,32,33)/p+1