3-[[3-(1,4-diazepan-1-ylcarbonyl)-4-fluoranyl-phenyl]methyl]-4,5-dimethyl-1H-pyridazin-6-one

Systemtic Name: 3-[[3-(1,4-diazepan-1-ylcarbonyl)-4-fluoranyl-phenyl]methyl]-4,5-dimethyl-1H-pyridazin-6-one Openeye Name: 3-[[3-(1,4-diazepane-1-carbonyl)-4-fluoro-phenyl]methyl]-4,5-dimethyl-1H-pyridazin-6-one CAS Name: 3-[[3-[1,4-diazepan-1-yl(oxo)methyl]-4-fluorophenyl]methyl]-4,5-dimethyl-1H-pyridazin-6-one IUPAC Name: 3-[[3-(1,4-diazepane-1-carbonyl)-4-fluorophenyl]methyl]-4,5-dimethyl-1H-pyridazin-6-one Traditional Name: 3-[3-(1,4-diazepane-1-carbonyl)-4-fluoro-benzyl]-4,5-dimethyl-1H-pyridazin-6-one Formula: C19H23FN4O2 MolecularWeight: 358.409923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN=C1CC2=CC(=C(C=C2)F)C(=O)N3CCCNCC3)C

Isomeric SMILES

CC1=C(C(=O)NN=C1CC2=CC(=C(C=C2)F)C(=O)N3CCCNCC3)C

InChI

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