4-(4-fluorophenyl)-2-methyl-1-morpholin-4-yl-5-[2-[(phenylmethyl)amino]pyrimidin-4-yl]pyrazol-3-one

Systemtic Name: 4-(4-fluorophenyl)-2-methyl-1-morpholin-4-yl-5-[2-[(phenylmethyl)amino]pyrimidin-4-yl]pyrazol-3-one Openeye Name: 5-[2-(benzylamino)pyrimidin-4-yl]-4-(4-fluorophenyl)-2-methyl-1-morpholino-pyrazol-3-one CAS Name: 4-(4-fluorophenyl)-2-methyl-1-(4-morpholinyl)-5-[2-[(phenylmethyl)amino]-4-pyrimidinyl]-3-pyrazolone IUPAC Name: 5-[2-(benzylamino)pyrimidin-4-yl]-4-(4-fluorophenyl)-2-methyl-1-morpholin-4-ylpyrazol-3-one Traditional Name: 5-[2-(benzylamino)pyrimidin-4-yl]-4-(4-fluorophenyl)-2-methyl-1-morpholino-3-pyrazolin-3-one Formula: C25H25FN6O2 MolecularWeight: 460.503403

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(N1N2CCOCC2)C3=NC(=NC=C3)NCC4=CC=CC=C4)C5=CC=C(C=C5)F

Isomeric SMILES

CN1C(=O)C(=C(N1N2CCOCC2)C3=NC(=NC=C3)NCC4=CC=CC=C4)C5=CC=C(C=C5)F

InChI

InChI=1S/C25H25FN6O2/c1-30-24(33)22(19-7-9-20(26)10-8-19)23(32(30)31-13-15-34-16-14-31)21-11-12-27-25(29-21)28-17-18-5-3-2-4-6-18/h2-12H,13-17H2,1H3,(H,27,28,29)