N-[(3,4-dimethoxyphenyl)methyl]-1-[(1S,2S)-2-oxidanylcyclohexyl]-2-pyridin-2-yl-benzimidazole-5-carboxamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-1-[(1S,2S)-2-oxidanylcyclohexyl]-2-pyridin-2-yl-benzimidazole-5-carboxamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-1-[(1S,2S)-2-hydroxycyclohexyl]-2-(2-pyridyl)benzimidazole-5-carboxamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-1-[(1S,2S)-2-hydroxycyclohexyl]-2-(2-pyridinyl)-5-benzimidazolecarboxamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-1-[(1S,2S)-2-hydroxycyclohexyl]-2-pyridin-2-ylbenzimidazole-5-carboxamide Traditional Name: 1-[(1S,2S)-2-hydroxycyclohexyl]-2-(2-pyridyl)-N-veratryl-benzimidazole-5-carboxamide Formula: C28H30N4O4 MolecularWeight: 486.5622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=CC3=C(C=C2)N(C(=N3)C4=CC=CC=N4)C5CCCCC5O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=CC3=C(C=C2)N(C(=N3)C4=CC=CC=N4)[C@H]5CCCC[C@@H]5O)OC

InChI

InChI=1S/C28H30N4O4/c1-35-25-13-10-18(15-26(25)36-2)17-30-28(34)19-11-12-22-21(16-19)31-27(20-7-5-6-14-29-20)32(22)23-8-3-4-9-24(23)33/h5-7,10-16,23-24,33H,3-4,8-9,17H2,1-2H3,(H,30,34)/t23-,24-/m0/s1