1-(phenylmethyl)-6-(pyridin-2-ylmethoxy)-4-(3-pyridin-3-ylpropanoyl)-1,4-diazepan-2-one

Systemtic Name: 1-(phenylmethyl)-6-(pyridin-2-ylmethoxy)-4-(3-pyridin-3-ylpropanoyl)-1,4-diazepan-2-one Openeye Name: 1-benzyl-6-(2-pyridylmethoxy)-4-[3-(3-pyridyl)propanoyl]-1,4-diazepan-2-one CAS Name: 4-[1-oxo-3-(3-pyridinyl)propyl]-1-(phenylmethyl)-6-(2-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-benzyl-6-(pyridin-2-ylmethoxy)-4-(3-pyridin-3-ylpropanoyl)-1,4-diazepan-2-one Traditional Name: 1-benzyl-6-(2-pyridylmethoxy)-4-[3-(3-pyridyl)propanoyl]-1,4-diazepan-2-one Formula: C26H28N4O3 MolecularWeight: 444.52552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C(=O)CN1C(=O)CCC2=CN=CC=C2)CC3=CC=CC=C3)OCC4=CC=CC=N4

Isomeric SMILES

C1C(CN(C(=O)CN1C(=O)CCC2=CN=CC=C2)CC3=CC=CC=C3)OCC4=CC=CC=N4

InChI

InChI=1S/C26H28N4O3/c31-25(12-11-21-9-6-13-27-15-21)30-18-24(33-20-23-10-4-5-14-28-23)17-29(26(32)19-30)16-22-7-2-1-3-8-22/h1-10,13-15,24H,11-12,16-20H2