1-cyclopentyl-2-[4-[(3-fluorophenyl)methylcarbamoyl]phenyl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclopentyl-2-[4-[(3-fluorophenyl)methylcarbamoyl]phenyl]benzimidazole-5-carboxylic acid Openeye Name: 1-cyclopentyl-2-[4-[(3-fluorophenyl)methylcarbamoyl]phenyl]benzimidazole-5-carboxylic acid CAS Name: 1-cyclopentyl-2-[4-[[(3-fluorophenyl)methylamino]-oxomethyl]phenyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclopentyl-2-[4-[(3-fluorophenyl)methylcarbamoyl]phenyl]benzimidazole-5-carboxylic acid Traditional Name: 1-cyclopentyl-2-[4-[(3-fluorobenzyl)carbamoyl]phenyl]benzimidazole-5-carboxylic acid Formula: C27H24FN3O3 MolecularWeight: 457.496163

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC=C(C=C4)C(=O)NCC5=CC(=CC=C5)F

Isomeric SMILES

C1CCC(C1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC=C(C=C4)C(=O)NCC5=CC(=CC=C5)F

InChI

InChI=1S/C27H24FN3O3/c28-21-5-3-4-17(14-21)16-29-26(32)19-10-8-18(9-11-19)25-30-23-15-20(27(33)34)12-13-24(23)31(25)22-6-1-2-7-22/h3-5,8-15,22H,1-2,6-7,16H2,(H,29,32)(H,33,34)