1-(1-ethanoylpiperidin-4-yl)-4-(4-fluorophenyl)-5-[2-(1-methoxypropan-2-ylamino)pyrimidin-4-yl]-2-methyl-pyrazol-3-one

Systemtic Name: 1-(1-ethanoylpiperidin-4-yl)-4-(4-fluorophenyl)-5-[2-(1-methoxypropan-2-ylamino)pyrimidin-4-yl]-2-methyl-pyrazol-3-one Openeye Name: 1-(1-acetyl-4-piperidyl)-4-(4-fluorophenyl)-5-[2-[(2-methoxy-1-methyl-ethyl)amino]pyrimidin-4-yl]-2-methyl-pyrazol-3-one CAS Name: 1-(1-acetyl-4-piperidinyl)-4-(4-fluorophenyl)-5-[2-(1-methoxypropan-2-ylamino)-4-pyrimidinyl]-2-methyl-3-pyrazolone IUPAC Name: 1-(1-acetylpiperidin-4-yl)-4-(4-fluorophenyl)-5-[2-(1-methoxypropan-2-ylamino)pyrimidin-4-yl]-2-methylpyrazol-3-one Traditional Name: 1-(1-acetyl-4-piperidyl)-4-(4-fluorophenyl)-5-[2-[(2-methoxy-1-methyl-ethyl)amino]pyrimidin-4-yl]-2-methyl-3-pyrazolin-3-one Formula: C25H31FN6O3 MolecularWeight: 482.550443

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)NC1=NC=CC(=N1)C2=C(C(=O)N(N2C3CCN(CC3)C(=O)C)C)C4=CC=C(C=C4)F

Isomeric SMILES

CC(COC)NC1=NC=CC(=N1)C2=C(C(=O)N(N2C3CCN(CC3)C(=O)C)C)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H31FN6O3/c1-16(15-35-4)28-25-27-12-9-21(29-25)23-22(18-5-7-19(26)8-6-18)24(34)30(3)32(23)20-10-13-31(14-11-20)17(2)33/h5-9,12,16,20H,10-11,13-15H2,1-4H3,(H,27,28,29)