3-[[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]carbonyl]-1H-pyridazin-6-one

Systemtic Name: 3-[[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]carbonyl]-1H-pyridazin-6-one Openeye Name: 3-[4-[(4-fluorophenyl)methyl]-1,4-diazepane-1-carbonyl]-1H-pyridazin-6-one CAS Name: 3-[[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-oxomethyl]-1H-pyridazin-6-one IUPAC Name: 3-[4-[(4-fluorophenyl)methyl]-1,4-diazepane-1-carbonyl]-1H-pyridazin-6-one Traditional Name: 3-[4-(4-fluorobenzyl)-1,4-diazepane-1-carbonyl]-1H-pyridazin-6-one Formula: C17H19FN4O2 MolecularWeight: 330.356763

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=NNC(=O)C=C2)CC3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=NNC(=O)C=C2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C17H19FN4O2/c18-14-4-2-13(3-5-14)12-21-8-1-9-22(11-10-21)17(24)15-6-7-16(23)20-19-15/h2-7H,1,8-12H2,(H,20,23)