1-cyclohexyl-2-[3-(pyridin-4-ylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclohexyl-2-[3-(pyridin-4-ylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid Openeye Name: 1-cyclohexyl-2-[3-(4-pyridylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid CAS Name: 1-cyclohexyl-2-[3-[oxo-(pyridin-4-ylamino)methyl]phenyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclohexyl-2-[3-(pyridin-4-ylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid Traditional Name: 1-cyclohexyl-2-[3-(4-pyridylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid Formula: C26H24N4O3 MolecularWeight: 440.49376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC(=CC=C4)C(=O)NC5=CC=NC=C5

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC(=CC=C4)C(=O)NC5=CC=NC=C5

InChI

InChI=1S/C26H24N4O3/c31-25(28-20-11-13-27-14-12-20)18-6-4-5-17(15-18)24-29-22-16-19(26(32)33)9-10-23(22)30(24)21-7-2-1-3-8-21/h4-6,9-16,21H,1-3,7-8H2,(H,32,33)(H,27,28,31)