1-[(3-fluorophenyl)methyl]-4-[2-(methylamino)pyridin-3-yl]carbonyl-piperazin-2-one

Systemtic Name: 1-[(3-fluorophenyl)methyl]-4-[2-(methylamino)pyridin-3-yl]carbonyl-piperazin-2-one Openeye Name: 1-[(3-fluorophenyl)methyl]-4-[2-(methylamino)pyridine-3-carbonyl]piperazin-2-one CAS Name: 1-[(3-fluorophenyl)methyl]-4-[[2-(methylamino)-3-pyridinyl]-oxomethyl]-2-piperazinone IUPAC Name: 1-[(3-fluorophenyl)methyl]-4-[2-(methylamino)pyridine-3-carbonyl]piperazin-2-one Traditional Name: 1-(3-fluorobenzyl)-4-[2-(methylamino)nicotinoyl]piperazin-2-one Formula: C18H19FN4O2 MolecularWeight: 342.367463

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=CC=N1)C(=O)N2CCN(C(=O)C2)CC3=CC(=CC=C3)F

Isomeric SMILES

CNC1=C(C=CC=N1)C(=O)N2CCN(C(=O)C2)CC3=CC(=CC=C3)F

InChI

InChI=1S/C18H19FN4O2/c1-20-17-15(6-3-7-21-17)18(25)23-9-8-22(16(24)12-23)11-13-4-2-5-14(19)10-13/h2-7,10H,8-9,11-12H2,1H3,(H,20,21)