1-cyclopentyl-2-(4-methylsulfonylphenyl)benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclopentyl-2-(4-methylsulfonylphenyl)benzimidazole-5-carboxylic acid Openeye Name: 1-cyclopentyl-2-(4-methylsulfonylphenyl)benzimidazole-5-carboxylic acid CAS Name: 1-cyclopentyl-2-(4-methylsulfonylphenyl)-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclopentyl-2-(4-methylsulfonylphenyl)benzimidazole-5-carboxylic acid Traditional Name: 1-cyclopentyl-2-(4-mesylphenyl)benzimidazole-5-carboxylic acid Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=NC3=C(N2C4CCCC4)C=CC(=C3)C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=NC3=C(N2C4CCCC4)C=CC(=C3)C(=O)O

InChI

InChI=1S/C20H20N2O4S/c1-27(25,26)16-9-6-13(7-10-16)19-21-17-12-14(20(23)24)8-11-18(17)22(19)15-4-2-3-5-15/h6-12,15H,2-5H2,1H3,(H,23,24)