5-[2-(2-fluoranylphenoxy)pyrimidin-4-yl]-4-(4-fluorophenyl)-1-methyl-2-piperidin-4-yl-pyrazol-3-one

Systemtic Name: 5-[2-(2-fluoranylphenoxy)pyrimidin-4-yl]-4-(4-fluorophenyl)-1-methyl-2-piperidin-4-yl-pyrazol-3-one Openeye Name: 5-[2-(2-fluorophenoxy)pyrimidin-4-yl]-4-(4-fluorophenyl)-1-methyl-2-(4-piperidyl)pyrazol-3-one CAS Name: 5-[2-(2-fluorophenoxy)-4-pyrimidinyl]-4-(4-fluorophenyl)-1-methyl-2-(4-piperidinyl)-3-pyrazolone IUPAC Name: 5-[2-(2-fluorophenoxy)pyrimidin-4-yl]-4-(4-fluorophenyl)-1-methyl-2-piperidin-4-ylpyrazol-3-one Traditional Name: 5-[2-(2-fluorophenoxy)pyrimidin-4-yl]-4-(4-fluorophenyl)-1-methyl-2-(4-piperidyl)-3-pyrazolin-3-one Formula: C25H23F2N5O2 MolecularWeight: 463.479226

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N1C2CCNCC2)C3=CC=C(C=C3)F)C4=NC(=NC=C4)OC5=CC=CC=C5F

Isomeric SMILES

CN1C(=C(C(=O)N1C2CCNCC2)C3=CC=C(C=C3)F)C4=NC(=NC=C4)OC5=CC=CC=C5F

InChI

InChI=1S/C25H23F2N5O2/c1-31-23(20-12-15-29-25(30-20)34-21-5-3-2-4-19(21)27)22(16-6-8-17(26)9-7-16)24(33)32(31)18-10-13-28-14-11-18/h2-9,12,15,18,28H,10-11,13-14H2,1H3