1-cyclohexyl-2-[4-[[5-(dimethylcarbamoyl)-2-(4-methylsulfonylphenyl)phenyl]methoxy]phenyl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclohexyl-2-[4-[[5-(dimethylcarbamoyl)-2-(4-methylsulfonylphenyl)phenyl]methoxy]phenyl]benzimidazole-5-carboxylic acid Openeye Name: 1-cyclohexyl-2-[4-[[5-(dimethylcarbamoyl)-2-(4-methylsulfonylphenyl)phenyl]methoxy]phenyl]benzimidazole-5-carboxylic acid CAS Name: 1-cyclohexyl-2-[4-[[5-[dimethylamino(oxo)methyl]-2-(4-methylsulfonylphenyl)phenyl]methoxy]phenyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclohexyl-2-[4-[[5-(dimethylcarbamoyl)-2-(4-methylsulfonylphenyl)phenyl]methoxy]phenyl]benzimidazole-5-carboxylic acid Traditional Name: 1-cyclohexyl-2-[4-[5-(dimethylcarbamoyl)-2-(4-mesylphenyl)benzyl]oxyphenyl]benzimidazole-5-carboxylic acid Formula: C37H37N3O6S MolecularWeight: 651.77118

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC(=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)C)COC3=CC=C(C=C3)C4=NC5=C(N4C6CCCCC6)C=CC(=C5)C(=O)O

Isomeric SMILES

CN(C)C(=O)C1=CC(=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)C)COC3=CC=C(C=C3)C4=NC5=C(N4C6CCCCC6)C=CC(=C5)C(=O)O

InChI

InChI=1S/C37H37N3O6S/c1-39(2)36(41)26-13-19-32(24-11-17-31(18-12-24)47(3,44)45)28(21-26)23-46-30-15-9-25(10-16-30)35-38-33-22-27(37(42)43)14-20-34(33)40(35)29-7-5-4-6-8-29/h9-22,29H,4-8,23H2,1-3H3,(H,42,43)