1-cyclohexyl-N-[(3-methoxy-4-oxidanyl-phenyl)methyl]-2-pyridin-2-yl-benzimidazole-5-carboxamide

Systemtic Name: 1-cyclohexyl-N-[(3-methoxy-4-oxidanyl-phenyl)methyl]-2-pyridin-2-yl-benzimidazole-5-carboxamide Openeye Name: 1-cyclohexyl-N-[(4-hydroxy-3-methoxy-phenyl)methyl]-2-(2-pyridyl)benzimidazole-5-carboxamide CAS Name: 1-cyclohexyl-N-[(4-hydroxy-3-methoxyphenyl)methyl]-2-(2-pyridinyl)-5-benzimidazolecarboxamide IUPAC Name: 1-cyclohexyl-N-[(4-hydroxy-3-methoxyphenyl)methyl]-2-pyridin-2-ylbenzimidazole-5-carboxamide Traditional Name: 1-cyclohexyl-2-(2-pyridyl)-N-vanillyl-benzimidazole-5-carboxamide Formula: C27H28N4O3 MolecularWeight: 456.53622

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC(=O)C2=CC3=C(C=C2)N(C(=N3)C4=CC=CC=N4)C5CCCCC5)O

Isomeric SMILES

COC1=C(C=CC(=C1)CNC(=O)C2=CC3=C(C=C2)N(C(=N3)C4=CC=CC=N4)C5CCCCC5)O

InChI

InChI=1S/C27H28N4O3/c1-34-25-15-18(10-13-24(25)32)17-29-27(33)19-11-12-23-22(16-19)30-26(21-9-5-6-14-28-21)31(23)20-7-3-2-4-8-20/h5-6,9-16,20,32H,2-4,7-8,17H2,1H3,(H,29,33)