N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-2-[[3-(phenylsulfonyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl]ethanamide

Systemtic Name: N-[4-chloranyl-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-benzoyl-4-chloro-phenyl)acetamide CAS Name: 2-[[3-(benzenesulfonyl)-1H-benzimidazol-3-ium-2-yl]thio]-N-(2-benzoyl-4-chlorophenyl)acetamide IUPAC Name: 2-[[3-(benzenesulfonyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl]-N-(2-benzoyl-4-chlorophenyl)acetamide Traditional Name: N-(2-benzoyl-4-chloro-phenyl)-2-[(3-besyl-1H-benzimidazol-3-ium-2-yl)thio]acetamide Formula: C28H21ClN3O4S2+ MolecularWeight: 563.06704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H20ClN3O4S2/c29-20-15-16-23(22(17-20)27(34)19-9-3-1-4-10-19)30-26(33)18-37-28-31-24-13-7-8-14-25(24)32(28)38(35,36)21-11-5-2-6-12-21/h1-17H,18H2,(H,30,33,34)/p+1