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

Systemtic Name: 1-(2-methylpropyl)-4-[(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)carbonyl]-6-phenylmethoxy-1,4-diazepan-2-one Openeye Name: 6-benzyloxy-1-isobutyl-4-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)-1,4-diazepan-2-one CAS Name: 1-(2-methylpropyl)-4-[oxo-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)methyl]-6-phenylmethoxy-1,4-diazepan-2-one IUPAC Name: 1-(2-methylpropyl)-4-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)-6-phenylmethoxy-1,4-diazepan-2-one Traditional Name: 6-benzoxy-1-isobutyl-4-(6-keto-4,5-dihydro-1H-pyridazine-3-carbonyl)-1,4-diazepan-2-one Formula: C21H28N4O4 MolecularWeight: 400.47142

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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=C3

Isomeric SMILES

CC(C)CN1CC(CN(CC1=O)C(=O)C2=NNC(=O)CC2)OCC3=CC=CC=C3

InChI

InChI=1S/C21H28N4O4/c1-15(2)10-24-11-17(29-14-16-6-4-3-5-7-16)12-25(13-20(24)27)21(28)18-8-9-19(26)23-22-18/h3-7,15,17H,8-14H2,1-2H3,(H,23,26)