1-cyclohexyl-2-[3-[[3-(pyridin-3-ylcarbonylamino)phenyl]carbamoyl]phenyl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclohexyl-2-[3-[[3-(pyridin-3-ylcarbonylamino)phenyl]carbamoyl]phenyl]benzimidazole-5-carboxylic acid Openeye Name: 1-cyclohexyl-2-[3-[[3-(pyridine-3-carbonylamino)phenyl]carbamoyl]phenyl]benzimidazole-5-carboxylic acid CAS Name: 1-cyclohexyl-2-[3-[oxo-[3-[[oxo(3-pyridinyl)methyl]amino]anilino]methyl]phenyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclohexyl-2-[3-[[3-(pyridine-3-carbonylamino)phenyl]carbamoyl]phenyl]benzimidazole-5-carboxylic acid Traditional Name: 1-cyclohexyl-2-[3-[(3-nicotinamidophenyl)carbamoyl]phenyl]benzimidazole-5-carboxylic acid Formula: C33H29N5O4 MolecularWeight: 559.61446

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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(=CC=C5)NC(=O)C6=CN=CC=C6

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC(=CC=C4)C(=O)NC5=CC(=CC=C5)NC(=O)C6=CN=CC=C6

InChI

InChI=1S/C33H29N5O4/c39-31(35-25-10-5-11-26(19-25)36-32(40)24-9-6-16-34-20-24)22-8-4-7-21(17-22)30-37-28-18-23(33(41)42)14-15-29(28)38(30)27-12-2-1-3-13-27/h4-11,14-20,27H,1-3,12-13H2,(H,35,39)(H,36,40)(H,41,42)