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

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

Systemtic Name:1-cyclohexyl-2-[3-(pyridin-3-ylmethylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid
Openeye Name:1-cyclohexyl-2-[3-(3-pyridylmethylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid
CAS Name:1-cyclohexyl-2-[3-[oxo-(3-pyridinylmethylamino)methyl]phenyl]-5-benzimidazolecarboxylic acid
IUPAC Name:1-cyclohexyl-2-[3-(pyridin-3-ylmethylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid
Traditional Name:1-cyclohexyl-2-[3-(3-pyridylmethylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid
Formula: C27H26N4O3
MolecularWeight: 454.52034
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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)NCC5=CN=CC=C5


Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC(=CC=C4)C(=O)NCC5=CN=CC=C5


InChI

InChI=1S/C27H26N4O3/c32-26(29-17-18-6-5-13-28-16-18)20-8-4-7-19(14-20)25-30-23-15-21(27(33)34)11-12-24(23)31(25)22-9-2-1-3-10-22/h4-8,11-16,22H,1-3,9-10,17H2,(H,29,32)(H,33,34)


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