6-[(3S)-1-[[1-(4-fluorophenyl)pyrazol-4-yl]methyl]piperidin-3-yl]-1H-pyrimidin-4-one

Systemtic Name: 6-[(3S)-1-[[1-(4-fluorophenyl)pyrazol-4-yl]methyl]piperidin-3-yl]-1H-pyrimidin-4-one Openeye Name: 6-[(3S)-1-[[1-(4-fluorophenyl)pyrazol-4-yl]methyl]-3-piperidyl]-1H-pyrimidin-4-one CAS Name: 6-[(3S)-1-[[1-(4-fluorophenyl)-4-pyrazolyl]methyl]-3-piperidinyl]-1H-pyrimidin-4-one IUPAC Name: 6-[(3S)-1-[[1-(4-fluorophenyl)pyrazol-4-yl]methyl]piperidin-3-yl]-1H-pyrimidin-4-one Traditional Name: 6-[(3S)-1-[[1-(4-fluorophenyl)pyrazol-4-yl]methyl]-3-piperidyl]-1H-pyrimidin-4-one Formula: C19H20FN5O MolecularWeight: 353.393403

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CN(N=C2)C3=CC=C(C=C3)F)C4=CC(=O)N=CN4

Isomeric SMILES

C1C[C@@H](CN(C1)CC2=CN(N=C2)C3=CC=C(C=C3)F)C4=CC(=O)N=CN4

InChI

InChI=1S/C19H20FN5O/c20-16-3-5-17(6-4-16)25-11-14(9-23-25)10-24-7-1-2-15(12-24)18-8-19(26)22-13-21-18/h3-6,8-9,11,13,15H,1-2,7,10,12H2,(H,21,22,26)/t15-/m0/s1