2-[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]sulfanyl-N-(2-nitrophenyl)ethanamide

Systemtic Name: 2-[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]sulfanyl-N-(2-nitrophenyl)ethanamide Openeye Name: 2-[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]sulfanyl-N-(2-nitrophenyl)acetamide CAS Name: 2-[[1-butyl-5-(dimethylsulfamoyl)-2-benzimidazolyl]thio]-N-(2-nitrophenyl)acetamide IUPAC Name: 2-[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]sulfanyl-N-(2-nitrophenyl)acetamide Traditional Name: 2-[[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]thio]-N-(2-nitrophenyl)acetamide Formula: C21H25N5O5S2 MolecularWeight: 491.5837

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1SCC(=O)NC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1SCC(=O)NC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H25N5O5S2/c1-4-5-12-25-18-11-10-15(33(30,31)24(2)3)13-17(18)23-21(25)32-14-20(27)22-16-8-6-7-9-19(16)26(28)29/h6-11,13H,4-5,12,14H2,1-3H3,(H,22,27)