1-cyclopentyl-2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)carbonylphenyl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclopentyl-2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)carbonylphenyl]benzimidazole-5-carboxylic acid Openeye Name: 1-cyclopentyl-2-[4-(4-pyrimidin-2-ylpiperazine-1-carbonyl)phenyl]benzimidazole-5-carboxylic acid CAS Name: 1-cyclopentyl-2-[4-[oxo-[4-(2-pyrimidinyl)-1-piperazinyl]methyl]phenyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclopentyl-2-[4-(4-pyrimidin-2-ylpiperazine-1-carbonyl)phenyl]benzimidazole-5-carboxylic acid Traditional Name: 1-cyclopentyl-2-[4-[4-(2-pyrimidyl)piperazine-1-carbonyl]phenyl]benzimidazole-5-carboxylic acid Formula: C28H28N6O3 MolecularWeight: 496.56032

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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)N5CCN(CC5)C6=NC=CC=N6

Isomeric SMILES

C1CCC(C1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC=C(C=C4)C(=O)N5CCN(CC5)C6=NC=CC=N6

InChI

InChI=1S/C28H28N6O3/c35-26(32-14-16-33(17-15-32)28-29-12-3-13-30-28)20-8-6-19(7-9-20)25-31-23-18-21(27(36)37)10-11-24(23)34(25)22-4-1-2-5-22/h3,6-13,18,22H,1-2,4-5,14-17H2,(H,36,37)