N-(4-piperidin-1-ylphenyl)-2-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-piperidin-1-ylphenyl)-2-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-[4-(1-piperidyl)phenyl]-2-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-[4-(1-piperidinyl)phenyl]-2-[(1-propyl-5-sulfamoyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-(4-piperidin-1-ylphenyl)-2-(1-propyl-5-sulfamoylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-(4-piperidinophenyl)-2-[(1-propyl-5-sulfamoyl-benzimidazol-2-yl)thio]acetamide Formula: C23H29N5O3S2 MolecularWeight: 487.63806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)NC3=CC=C(C=C3)N4CCCCC4

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)NC3=CC=C(C=C3)N4CCCCC4

InChI

InChI=1S/C23H29N5O3S2/c1-2-12-28-21-11-10-19(33(24,30)31)15-20(21)26-23(28)32-16-22(29)25-17-6-8-18(9-7-17)27-13-4-3-5-14-27/h6-11,15H,2-5,12-14,16H2,1H3,(H,25,29)(H2,24,30,31)