3-[[3-(1,4-diazepan-1-ylcarbonyl)-4-fluoranyl-phenyl]methyl]-4-ethyl-1H-pyridazin-6-one

Systemtic Name: 3-[[3-(1,4-diazepan-1-ylcarbonyl)-4-fluoranyl-phenyl]methyl]-4-ethyl-1H-pyridazin-6-one Openeye Name: 3-[[3-(1,4-diazepane-1-carbonyl)-4-fluoro-phenyl]methyl]-4-ethyl-1H-pyridazin-6-one CAS Name: 3-[[3-[1,4-diazepan-1-yl(oxo)methyl]-4-fluorophenyl]methyl]-4-ethyl-1H-pyridazin-6-one IUPAC Name: 3-[[3-(1,4-diazepane-1-carbonyl)-4-fluorophenyl]methyl]-4-ethyl-1H-pyridazin-6-one Traditional Name: 3-[3-(1,4-diazepane-1-carbonyl)-4-fluoro-benzyl]-4-ethyl-1H-pyridazin-6-one Formula: C19H23FN4O2 MolecularWeight: 358.409923

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)NN=C1CC2=CC(=C(C=C2)F)C(=O)N3CCCNCC3

Isomeric SMILES

CCC1=CC(=O)NN=C1CC2=CC(=C(C=C2)F)C(=O)N3CCCNCC3

InChI

InChI=1S/C19H23FN4O2/c1-2-14-12-18(25)23-22-17(14)11-13-4-5-16(20)15(10-13)19(26)24-8-3-6-21-7-9-24/h4-5,10,12,21H,2-3,6-9,11H2,1H3,(H,23,25)