2-[4-[[(4-fluorophenyl)methylamino]methyl]pyridin-2-yl]-4-pyridin-3-yl-1H-pyrazol-3-one

Systemtic Name: 2-[4-[[(4-fluorophenyl)methylamino]methyl]pyridin-2-yl]-4-pyridin-3-yl-1H-pyrazol-3-one Openeye Name: 2-[4-[[(4-fluorophenyl)methylamino]methyl]-2-pyridyl]-4-(3-pyridyl)-1H-pyrazol-3-one CAS Name: 2-[4-[[(4-fluorophenyl)methylamino]methyl]-2-pyridinyl]-4-(3-pyridinyl)-1H-pyrazol-3-one IUPAC Name: 2-[4-[[(4-fluorophenyl)methylamino]methyl]pyridin-2-yl]-4-pyridin-3-yl-1H-pyrazol-3-one Traditional Name: 2-[4-[[(4-fluorobenzyl)amino]methyl]-2-pyridyl]-4-(3-pyridyl)-3-pyrazolin-3-one Formula: C21H18FN5O MolecularWeight: 375.398923

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=CNN(C2=O)C3=NC=CC(=C3)CNCC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC(=CN=C1)C2=CNN(C2=O)C3=NC=CC(=C3)CNCC4=CC=C(C=C4)F

InChI

InChI=1S/C21H18FN5O/c22-18-5-3-15(4-6-18)11-24-12-16-7-9-25-20(10-16)27-21(28)19(14-26-27)17-2-1-8-23-13-17/h1-10,13-14,24,26H,11-12H2