6-[4-[[2-butyl-5-(tert-butylsulfamoyl)benzimidazol-1-yl]methyl]phenyl]cyclohexa-2,4-diene-1-carboxylic acid

Systemtic Name: 6-[4-[[2-butyl-5-(tert-butylsulfamoyl)benzimidazol-1-yl]methyl]phenyl]cyclohexa-2,4-diene-1-carboxylic acid Openeye Name: 6-[4-[[2-butyl-5-(tert-butylsulfamoyl)benzimidazol-1-yl]methyl]phenyl]cyclohexa-2,4-diene-1-carboxylic acid CAS Name: 6-[4-[[2-butyl-5-(tert-butylsulfamoyl)-1-benzimidazolyl]methyl]phenyl]-1-cyclohexa-2,4-dienecarboxylic acid IUPAC Name: 6-[4-[[2-butyl-5-(tert-butylsulfamoyl)benzimidazol-1-yl]methyl]phenyl]cyclohexa-2,4-diene-1-carboxylic acid Traditional Name: 6-[4-[[2-butyl-5-(tert-butylsulfamoyl)benzimidazol-1-yl]methyl]phenyl]cyclohexa-2,4-diene-1-carboxylic acid Formula: C29H35N3O4S MolecularWeight: 521.6709

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)C4C=CC=CC4C(=O)O)C=CC(=C2)S(=O)(=O)NC(C)(C)C

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)C4C=CC=CC4C(=O)O)C=CC(=C2)S(=O)(=O)NC(C)(C)C

InChI

InChI=1S/C29H35N3O4S/c1-5-6-11-27-30-25-18-22(37(35,36)31-29(2,3)4)16-17-26(25)32(27)19-20-12-14-21(15-13-20)23-9-7-8-10-24(23)28(33)34/h7-10,12-18,23-24,31H,5-6,11,19H2,1-4H3,(H,33,34)