1-ethyl-4-(4-fluorophenyl)-2-morpholin-4-yl-5-(2-phenoxypyrimidin-4-yl)pyrazol-3-one

Systemtic Name: 1-ethyl-4-(4-fluorophenyl)-2-morpholin-4-yl-5-(2-phenoxypyrimidin-4-yl)pyrazol-3-one Openeye Name: 1-ethyl-4-(4-fluorophenyl)-2-morpholino-5-(2-phenoxypyrimidin-4-yl)pyrazol-3-one CAS Name: 1-ethyl-4-(4-fluorophenyl)-2-(4-morpholinyl)-5-(2-phenoxy-4-pyrimidinyl)-3-pyrazolone IUPAC Name: 1-ethyl-4-(4-fluorophenyl)-2-morpholin-4-yl-5-(2-phenoxypyrimidin-4-yl)pyrazol-3-one Traditional Name: 1-ethyl-4-(4-fluorophenyl)-2-morpholino-5-(2-phenoxypyrimidin-4-yl)-3-pyrazolin-3-one Formula: C25H24FN5O3 MolecularWeight: 461.488163

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=O)N1N2CCOCC2)C3=CC=C(C=C3)F)C4=NC(=NC=C4)OC5=CC=CC=C5

Isomeric SMILES

CCN1C(=C(C(=O)N1N2CCOCC2)C3=CC=C(C=C3)F)C4=NC(=NC=C4)OC5=CC=CC=C5

InChI

InChI=1S/C25H24FN5O3/c1-2-30-23(21-12-13-27-25(28-21)34-20-6-4-3-5-7-20)22(18-8-10-19(26)11-9-18)24(32)31(30)29-14-16-33-17-15-29/h3-13H,2,14-17H2,1H3