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

Systemtic Name: 2-ethyl-5-[2-(3-fluoranylphenoxy)pyrimidin-4-yl]-4-(4-fluorophenyl)-1-piperidin-4-yl-pyrazol-3-one Openeye Name: 2-ethyl-5-[2-(3-fluorophenoxy)pyrimidin-4-yl]-4-(4-fluorophenyl)-1-(4-piperidyl)pyrazol-3-one CAS Name: 2-ethyl-5-[2-(3-fluorophenoxy)-4-pyrimidinyl]-4-(4-fluorophenyl)-1-(4-piperidinyl)-3-pyrazolone IUPAC Name: 2-ethyl-5-[2-(3-fluorophenoxy)pyrimidin-4-yl]-4-(4-fluorophenyl)-1-piperidin-4-ylpyrazol-3-one Traditional Name: 2-ethyl-5-[2-(3-fluorophenoxy)pyrimidin-4-yl]-4-(4-fluorophenyl)-1-(4-piperidyl)-3-pyrazolin-3-one Formula: C26H25F2N5O2 MolecularWeight: 477.505806

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=C(N1C2CCNCC2)C3=NC(=NC=C3)OC4=CC(=CC=C4)F)C5=CC=C(C=C5)F

Isomeric SMILES

CCN1C(=O)C(=C(N1C2CCNCC2)C3=NC(=NC=C3)OC4=CC(=CC=C4)F)C5=CC=C(C=C5)F

InChI

InChI=1S/C26H25F2N5O2/c1-2-32-25(34)23(17-6-8-18(27)9-7-17)24(33(32)20-10-13-29-14-11-20)22-12-15-30-26(31-22)35-21-5-3-4-19(28)16-21/h3-9,12,15-16,20,29H,2,10-11,13-14H2,1H3