2-(4-chlorophenyl)-1-cyclohexyl-6-[(3-methylsulfonylphenyl)methoxy]-4-phenyl-benzimidazole-5-carboxylic acid

Systemtic Name: 2-(4-chlorophenyl)-1-cyclohexyl-6-[(3-methylsulfonylphenyl)methoxy]-4-phenyl-benzimidazole-5-carboxylic acid Openeye Name: 2-(4-chlorophenyl)-1-cyclohexyl-6-[(3-methylsulfonylphenyl)methoxy]-4-phenyl-benzimidazole-5-carboxylic acid CAS Name: 2-(4-chlorophenyl)-1-cyclohexyl-6-[(3-methylsulfonylphenyl)methoxy]-4-phenyl-5-benzimidazolecarboxylic acid IUPAC Name: 2-(4-chlorophenyl)-1-cyclohexyl-6-[(3-methylsulfonylphenyl)methoxy]-4-phenylbenzimidazole-5-carboxylic acid Traditional Name: 2-(4-chlorophenyl)-1-cyclohexyl-6-(3-mesylbenzyl)oxy-4-phenyl-benzimidazole-5-carboxylic acid Formula: C34H31ClN2O5S MolecularWeight: 615.13834

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)COC2=C(C(=C3C(=C2)N(C(=N3)C4=CC=C(C=C4)Cl)C5CCCCC5)C6=CC=CC=C6)C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)COC2=C(C(=C3C(=C2)N(C(=N3)C4=CC=C(C=C4)Cl)C5CCCCC5)C6=CC=CC=C6)C(=O)O

InChI

InChI=1S/C34H31ClN2O5S/c1-43(40,41)27-14-8-9-22(19-27)21-42-29-20-28-32(30(31(29)34(38)39)23-10-4-2-5-11-23)36-33(24-15-17-25(35)18-16-24)37(28)26-12-6-3-7-13-26/h2,4-5,8-11,14-20,26H,3,6-7,12-13,21H2,1H3,(H,38,39)