1-[4-[3-(3-chloranyl-5-fluoranyl-phenyl)-4-pyrimidin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-2-oxidanyl-ethanone

Systemtic Name: 1-[4-[3-(3-chloranyl-5-fluoranyl-phenyl)-4-pyrimidin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-2-oxidanyl-ethanone Openeye Name: 1-[4-[3-(3-chloro-5-fluoro-phenyl)-4-pyrimidin-4-yl-1H-pyrazol-5-yl]-1-piperidyl]-2-hydroxy-ethanone CAS Name: 1-[4-[3-(3-chloro-5-fluorophenyl)-4-(4-pyrimidinyl)-1H-pyrazol-5-yl]-1-piperidinyl]-2-hydroxyethanone IUPAC Name: 1-[4-[3-(3-chloro-5-fluorophenyl)-4-pyrimidin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-2-hydroxyethanone Traditional Name: 1-[4-[3-(3-chloro-5-fluoro-phenyl)-4-(4-pyrimidyl)-1H-pyrazol-5-yl]piperidino]-2-hydroxy-ethanone Formula: C20H19ClFN5O2 MolecularWeight: 415.848563

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=C(C(=NN2)C3=CC(=CC(=C3)Cl)F)C4=NC=NC=C4)C(=O)CO

Isomeric SMILES

C1CN(CCC1C2=C(C(=NN2)C3=CC(=CC(=C3)Cl)F)C4=NC=NC=C4)C(=O)CO

InChI

InChI=1S/C20H19ClFN5O2/c21-14-7-13(8-15(22)9-14)20-18(16-1-4-23-11-24-16)19(25-26-20)12-2-5-27(6-3-12)17(29)10-28/h1,4,7-9,11-12,28H,2-3,5-6,10H2,(H,25,26)