2-(1-butyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-N-(2-chloranyl-5-nitro-phenyl)ethanamide

Systemtic Name: 2-(1-butyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-N-(2-chloranyl-5-nitro-phenyl)ethanamide Openeye Name: 2-(1-butyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-N-(2-chloro-5-nitro-phenyl)acetamide CAS Name: 2-[(1-butyl-5-sulfamoyl-2-benzimidazolyl)thio]-N-(2-chloro-5-nitrophenyl)acetamide IUPAC Name: 2-(1-butyl-5-sulfamoylbenzimidazol-2-yl)sulfanyl-N-(2-chloro-5-nitrophenyl)acetamide Traditional Name: 2-[(1-butyl-5-sulfamoyl-benzimidazol-2-yl)thio]-N-(2-chloro-5-nitro-phenyl)acetamide Formula: C19H20ClN5O5S2 MolecularWeight: 497.9756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20ClN5O5S2/c1-2-3-8-24-17-7-5-13(32(21,29)30)10-16(17)23-19(24)31-11-18(26)22-15-9-12(25(27)28)4-6-14(15)20/h4-7,9-10H,2-3,8,11H2,1H3,(H,22,26)(H2,21,29,30)