2-[1-butyl-5-(butylsulfamoyl)benzimidazol-2-yl]sulfanyl-N-(2,5-diethoxy-4-morpholin-4-yl-phenyl)ethanamide

Systemtic Name: 2-[1-butyl-5-(butylsulfamoyl)benzimidazol-2-yl]sulfanyl-N-(2,5-diethoxy-4-morpholin-4-yl-phenyl)ethanamide Openeye Name: 2-[1-butyl-5-(butylsulfamoyl)benzimidazol-2-yl]sulfanyl-N-(2,5-diethoxy-4-morpholino-phenyl)acetamide CAS Name: 2-[[1-butyl-5-(butylsulfamoyl)-2-benzimidazolyl]thio]-N-[2,5-diethoxy-4-(4-morpholinyl)phenyl]acetamide IUPAC Name: 2-[1-butyl-5-(butylsulfamoyl)benzimidazol-2-yl]sulfanyl-N-(2,5-diethoxy-4-morpholin-4-ylphenyl)acetamide Traditional Name: 2-[[1-butyl-5-(butylsulfamoyl)benzimidazol-2-yl]thio]-N-(2,5-diethoxy-4-morpholino-phenyl)acetamide Formula: C31H45N5O6S2 MolecularWeight: 647.8489

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC(=O)NC3=C(C=C(C(=C3)OCC)N4CCOCC4)OCC)CCCC

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC(=O)NC3=C(C=C(C(=C3)OCC)N4CCOCC4)OCC)CCCC

InChI

InChI=1S/C31H45N5O6S2/c1-5-9-13-32-44(38,39)23-11-12-26-24(19-23)34-31(36(26)14-10-6-2)43-22-30(37)33-25-20-29(42-8-4)27(21-28(25)41-7-3)35-15-17-40-18-16-35/h11-12,19-21,32H,5-10,13-18,22H2,1-4H3,(H,33,37)