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

Systemtic Name: 1-(2-methylpropyl)-6-(pyridin-2-ylmethoxy)-4-(3-pyridin-4-ylpropanoyl)-1,4-diazepan-2-one Openeye Name: 1-isobutyl-6-(2-pyridylmethoxy)-4-[3-(4-pyridyl)propanoyl]-1,4-diazepan-2-one CAS Name: 1-(2-methylpropyl)-4-(1-oxo-3-pyridin-4-ylpropyl)-6-(2-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-(2-methylpropyl)-6-(pyridin-2-ylmethoxy)-4-(3-pyridin-4-ylpropanoyl)-1,4-diazepan-2-one Traditional Name: 1-isobutyl-6-(2-pyridylmethoxy)-4-[3-(4-pyridyl)propanoyl]-1,4-diazepan-2-one Formula: C23H30N4O3 MolecularWeight: 410.5093

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CC(CN(CC1=O)C(=O)CCC2=CC=NC=C2)OCC3=CC=CC=N3

Isomeric SMILES

CC(C)CN1CC(CN(CC1=O)C(=O)CCC2=CC=NC=C2)OCC3=CC=CC=N3

InChI

InChI=1S/C23H30N4O3/c1-18(2)13-26-14-21(30-17-20-5-3-4-10-25-20)15-27(16-23(26)29)22(28)7-6-19-8-11-24-12-9-19/h3-5,8-12,18,21H,6-7,13-17H2,1-2H3