4-(cyclopropylmethoxy)-4-[1-(cyclopropylmethyl)-7-methylsulfonyl-benzimidazol-2-yl]-1-phenyl-cyclohexane-1-carboxylic acid

Systemtic Name: 4-(cyclopropylmethoxy)-4-[1-(cyclopropylmethyl)-7-methylsulfonyl-benzimidazol-2-yl]-1-phenyl-cyclohexane-1-carboxylic acid Openeye Name: 4-(cyclopropylmethoxy)-4-[1-(cyclopropylmethyl)-7-methylsulfonyl-benzimidazol-2-yl]-1-phenyl-cyclohexanecarboxylic acid CAS Name: 4-(cyclopropylmethoxy)-4-[1-(cyclopropylmethyl)-7-methylsulfonyl-2-benzimidazolyl]-1-phenyl-1-cyclohexanecarboxylic acid IUPAC Name: 4-(cyclopropylmethoxy)-4-[1-(cyclopropylmethyl)-7-methylsulfonylbenzimidazol-2-yl]-1-phenylcyclohexane-1-carboxylic acid Traditional Name: 4-(cyclopropylmethoxy)-4-[1-(cyclopropylmethyl)-7-mesyl-benzimidazol-2-yl]-1-phenyl-cyclohexanecarboxylic acid Formula: C29H34N2O5S MolecularWeight: 522.65566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC2=C1N(C(=N2)C3(CCC(CC3)(C4=CC=CC=C4)C(=O)O)OCC5CC5)CC6CC6

Isomeric SMILES

CS(=O)(=O)C1=CC=CC2=C1N(C(=N2)C3(CCC(CC3)(C4=CC=CC=C4)C(=O)O)OCC5CC5)CC6CC6

InChI

InChI=1S/C29H34N2O5S/c1-37(34,35)24-9-5-8-23-25(24)31(18-20-10-11-20)26(30-23)29(36-19-21-12-13-21)16-14-28(15-17-29,27(32)33)22-6-3-2-4-7-22/h2-9,20-21H,10-19H2,1H3,(H,32,33)