2-[4-[[2-butyl-5-(cyclohexylsulfamoyl)benzimidazol-1-yl]methyl]phenyl]benzoic acid

Systemtic Name: 2-[4-[[2-butyl-5-(cyclohexylsulfamoyl)benzimidazol-1-yl]methyl]phenyl]benzoic acid Openeye Name: 2-[4-[[2-butyl-5-(cyclohexylsulfamoyl)benzimidazol-1-yl]methyl]phenyl]benzoic acid CAS Name: 2-[4-[[2-butyl-5-(cyclohexylsulfamoyl)-1-benzimidazolyl]methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[[2-butyl-5-(cyclohexylsulfamoyl)benzimidazol-1-yl]methyl]phenyl]benzoic acid Traditional Name: 2-[4-[[2-butyl-5-(cyclohexylsulfamoyl)benzimidazol-1-yl]methyl]phenyl]benzoic acid Formula: C31H35N3O4S MolecularWeight: 545.6923

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)C=CC(=C2)S(=O)(=O)NC5CCCCC5

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)C=CC(=C2)S(=O)(=O)NC5CCCCC5

InChI

InChI=1S/C31H35N3O4S/c1-2-3-13-30-32-28-20-25(39(37,38)33-24-9-5-4-6-10-24)18-19-29(28)34(30)21-22-14-16-23(17-15-22)26-11-7-8-12-27(26)31(35)36/h7-8,11-12,14-20,24,33H,2-6,9-10,13,21H2,1H3,(H,35,36)