N-(2-cyano-4-nitro-phenyl)-2-[5-(diethylsulfamoyl)-1-(2-methoxyphenyl)benzimidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-cyano-4-nitro-phenyl)-2-[5-(diethylsulfamoyl)-1-(2-methoxyphenyl)benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(2-cyano-4-nitro-phenyl)-2-[5-(diethylsulfamoyl)-1-(2-methoxyphenyl)benzimidazol-2-yl]sulfanyl-acetamide CAS Name: N-(2-cyano-4-nitrophenyl)-2-[[5-(diethylsulfamoyl)-1-(2-methoxyphenyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: N-(2-cyano-4-nitrophenyl)-2-[5-(diethylsulfamoyl)-1-(2-methoxyphenyl)benzimidazol-2-yl]sulfanylacetamide Traditional Name: N-(2-cyano-4-nitro-phenyl)-2-[[5-(diethylsulfamoyl)-1-(2-methoxyphenyl)benzimidazol-2-yl]thio]acetamide Formula: C27H26N6O6S2 MolecularWeight: 594.66194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])C#N)C4=CC=CC=C4OC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])C#N)C4=CC=CC=C4OC

InChI

InChI=1S/C27H26N6O6S2/c1-4-31(5-2)41(37,38)20-11-13-23-22(15-20)30-27(32(23)24-8-6-7-9-25(24)39-3)40-17-26(34)29-21-12-10-19(33(35)36)14-18(21)16-28/h6-15H,4-5,17H2,1-3H3,(H,29,34)