4-(1H-benzimidazol-2-ylmethyl)-1-cyclohexyl-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 4-(1H-benzimidazol-2-ylmethyl)-1-cyclohexyl-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 4-(1H-benzimidazol-2-ylmethyl)-1-cyclohexyl-6-(4-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 4-(1H-benzimidazol-2-ylmethyl)-1-cyclohexyl-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one IUPAC Name: 4-(1H-benzimidazol-2-ylmethyl)-1-cyclohexyl-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 4-(1H-benzimidazol-2-ylmethyl)-1-cyclohexyl-6-(4-pyridylmethoxy)-1,4-diazepan-2-one Formula: C25H31N5O2 MolecularWeight: 433.54594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC(CN(CC2=O)CC3=NC4=CC=CC=C4N3)OCC5=CC=NC=C5

Isomeric SMILES

C1CCC(CC1)N2CC(CN(CC2=O)CC3=NC4=CC=CC=C4N3)OCC5=CC=NC=C5

InChI

InChI=1S/C25H31N5O2/c31-25-17-29(16-24-27-22-8-4-5-9-23(22)28-24)14-21(32-18-19-10-12-26-13-11-19)15-30(25)20-6-2-1-3-7-20/h4-5,8-13,20-21H,1-3,6-7,14-18H2,(H,27,28)