4-(4-fluorophenyl)-2-(2-methoxyethyl)-1-methyl-5-[2-(1-phenylethylamino)pyrimidin-4-yl]pyrazol-3-one

Systemtic Name: 4-(4-fluorophenyl)-2-(2-methoxyethyl)-1-methyl-5-[2-(1-phenylethylamino)pyrimidin-4-yl]pyrazol-3-one Openeye Name: 4-(4-fluorophenyl)-2-(2-methoxyethyl)-1-methyl-5-[2-(1-phenylethylamino)pyrimidin-4-yl]pyrazol-3-one CAS Name: 4-(4-fluorophenyl)-2-(2-methoxyethyl)-1-methyl-5-[2-(1-phenylethylamino)-4-pyrimidinyl]-3-pyrazolone IUPAC Name: 4-(4-fluorophenyl)-2-(2-methoxyethyl)-1-methyl-5-[2-(1-phenylethylamino)pyrimidin-4-yl]pyrazol-3-one Traditional Name: 4-(4-fluorophenyl)-2-(2-methoxyethyl)-1-methyl-5-[2-(1-phenylethylamino)pyrimidin-4-yl]-3-pyrazolin-3-one Formula: C25H26FN5O2 MolecularWeight: 447.504643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)C3=C(C(=O)N(N3C)CCOC)C4=CC=C(C=C4)F

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)C3=C(C(=O)N(N3C)CCOC)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H26FN5O2/c1-17(18-7-5-4-6-8-18)28-25-27-14-13-21(29-25)23-22(19-9-11-20(26)12-10-19)24(32)31(30(23)2)15-16-33-3/h4-14,17H,15-16H2,1-3H3,(H,27,28,29)