1-(4-nitrophenyl)-2-[1-(phenylsulfonyl)benzimidazol-2-yl]sulfanyl-ethanone

Systemtic Name: 1-(4-nitrophenyl)-2-[1-(phenylsulfonyl)benzimidazol-2-yl]sulfanyl-ethanone Openeye Name: 2-[1-(benzenesulfonyl)benzimidazol-2-yl]sulfanyl-1-(4-nitrophenyl)ethanone CAS Name: 2-[[1-(benzenesulfonyl)-2-benzimidazolyl]thio]-1-(4-nitrophenyl)ethanone IUPAC Name: 2-[1-(benzenesulfonyl)benzimidazol-2-yl]sulfanyl-1-(4-nitrophenyl)ethanone Traditional Name: 2-[(1-besylbenzimidazol-2-yl)thio]-1-(4-nitrophenyl)ethanone Formula: C21H15N3O5S2 MolecularWeight: 453.4909

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)N2C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N2C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H15N3O5S2/c25-20(15-10-12-16(13-11-15)24(26)27)14-30-21-22-18-8-4-5-9-19(18)23(21)31(28,29)17-6-2-1-3-7-17/h1-13H,14H2