5-[4-(aminomethyl)piperidin-1-yl]-2-[2-(3-fluorophenyl)-2-oxidanylidene-ethyl]pyridazin-3-one

Systemtic Name: 5-[4-(aminomethyl)piperidin-1-yl]-2-[2-(3-fluorophenyl)-2-oxidanylidene-ethyl]pyridazin-3-one Openeye Name: 5-[4-(aminomethyl)-1-piperidyl]-2-[2-(3-fluorophenyl)-2-oxo-ethyl]pyridazin-3-one CAS Name: 5-[4-(aminomethyl)-1-piperidinyl]-2-[2-(3-fluorophenyl)-2-oxoethyl]-3-pyridazinone IUPAC Name: 5-[4-(aminomethyl)piperidin-1-yl]-2-[2-(3-fluorophenyl)-2-oxoethyl]pyridazin-3-one Traditional Name: 5-[4-(aminomethyl)piperidino]-2-[2-(3-fluorophenyl)-2-keto-ethyl]pyridazin-3-one Formula: C18H21FN4O2 MolecularWeight: 344.383343

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN)C2=CC(=O)N(N=C2)CC(=O)C3=CC(=CC=C3)F

Isomeric SMILES

C1CN(CCC1CN)C2=CC(=O)N(N=C2)CC(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C18H21FN4O2/c19-15-3-1-2-14(8-15)17(24)12-23-18(25)9-16(11-21-23)22-6-4-13(10-20)5-7-22/h1-3,8-9,11,13H,4-7,10,12,20H2