4-(4-fluorophenyl)-5-(2-methoxypyrimidin-4-yl)-1-methyl-2-piperidin-4-yl-pyrazol-3-one

Systemtic Name: 4-(4-fluorophenyl)-5-(2-methoxypyrimidin-4-yl)-1-methyl-2-piperidin-4-yl-pyrazol-3-one Openeye Name: 4-(4-fluorophenyl)-5-(2-methoxypyrimidin-4-yl)-1-methyl-2-(4-piperidyl)pyrazol-3-one CAS Name: 4-(4-fluorophenyl)-5-(2-methoxy-4-pyrimidinyl)-1-methyl-2-(4-piperidinyl)-3-pyrazolone IUPAC Name: 4-(4-fluorophenyl)-5-(2-methoxypyrimidin-4-yl)-1-methyl-2-piperidin-4-ylpyrazol-3-one Traditional Name: 4-(4-fluorophenyl)-5-(2-methoxypyrimidin-4-yl)-1-methyl-2-(4-piperidyl)-3-pyrazolin-3-one Formula: C20H22FN5O2 MolecularWeight: 383.419383

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C20H22FN5O2/c1-25-18(16-9-12-23-20(24-16)28-2)17(13-3-5-14(21)6-4-13)19(27)26(25)15-7-10-22-11-8-15/h3-6,9,12,15,22H,7-8,10-11H2,1-2H3