1-(2-methylpropyl)-4-[(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)carbonyl]-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 1-(2-methylpropyl)-4-[(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)carbonyl]-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 1-isobutyl-4-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)-6-(2-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 1-(2-methylpropyl)-4-[oxo-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)methyl]-6-(2-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-(2-methylpropyl)-4-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 1-isobutyl-4-(6-keto-4,5-dihydro-1H-pyridazine-3-carbonyl)-6-(2-pyridylmethoxy)-1,4-diazepan-2-one Formula: C20H27N5O4 MolecularWeight: 401.45948

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CC(CN(CC1=O)C(=O)C2=NNC(=O)CC2)OCC3=CC=CC=N3

Isomeric SMILES

CC(C)CN1CC(CN(CC1=O)C(=O)C2=NNC(=O)CC2)OCC3=CC=CC=N3

InChI

InChI=1S/C20H27N5O4/c1-14(2)9-24-10-16(29-13-15-5-3-4-8-21-15)11-25(12-19(24)27)20(28)17-6-7-18(26)23-22-17/h3-5,8,14,16H,6-7,9-13H2,1-2H3,(H,23,26)