2-(1-butyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-N-phenethyl-ethanamide

Systemtic Name: 2-(1-butyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-N-phenethyl-ethanamide Openeye Name: 2-(1-butyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-N-phenethyl-acetamide CAS Name: 2-[(1-butyl-5-sulfamoyl-2-benzimidazolyl)thio]-N-phenethylacetamide IUPAC Name: 2-(1-butyl-5-sulfamoylbenzimidazol-2-yl)sulfanyl-N-phenethylacetamide Traditional Name: 2-[(1-butyl-5-sulfamoyl-benzimidazol-2-yl)thio]-N-phenethyl-acetamide Formula: C21H26N4O3S2 MolecularWeight: 446.58614

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)NCCC3=CC=CC=C3

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C21H26N4O3S2/c1-2-3-13-25-19-10-9-17(30(22,27)28)14-18(19)24-21(25)29-15-20(26)23-12-11-16-7-5-4-6-8-16/h4-10,14H,2-3,11-13,15H2,1H3,(H,23,26)(H2,22,27,28)