N-(2-methoxy-5-nitro-phenyl)-2-[1-(phenylsulfonyl)benzimidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-2-[1-(phenylsulfonyl)benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: 2-[1-(benzenesulfonyl)benzimidazol-2-yl]sulfanyl-N-(2-methoxy-5-nitro-phenyl)acetamide CAS Name: 2-[[1-(benzenesulfonyl)-2-benzimidazolyl]thio]-N-(2-methoxy-5-nitrophenyl)acetamide IUPAC Name: 2-[1-(benzenesulfonyl)benzimidazol-2-yl]sulfanyl-N-(2-methoxy-5-nitrophenyl)acetamide Traditional Name: 2-[(1-besylbenzimidazol-2-yl)thio]-N-(2-methoxy-5-nitro-phenyl)acetamide Formula: C22H18N4O6S2 MolecularWeight: 498.53152

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CSC2=NC3=CC=CC=C3N2S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CSC2=NC3=CC=CC=C3N2S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H18N4O6S2/c1-32-20-12-11-15(26(28)29)13-18(20)23-21(27)14-33-22-24-17-9-5-6-10-19(17)25(22)34(30,31)16-7-3-2-4-8-16/h2-13H,14H2,1H3,(H,23,27)