3-ethyl-6-(3-fluoranyl-2-oxidanyl-phenyl)-2-methyl-5-phenethyl-pyrimidin-4-one

Systemtic Name: 3-ethyl-6-(3-fluoranyl-2-oxidanyl-phenyl)-2-methyl-5-phenethyl-pyrimidin-4-one Openeye Name: 3-ethyl-6-(3-fluoro-2-hydroxy-phenyl)-2-methyl-5-phenethyl-pyrimidin-4-one CAS Name: 3-ethyl-6-(3-fluoro-2-hydroxyphenyl)-2-methyl-5-phenethyl-4-pyrimidinone IUPAC Name: 3-ethyl-6-(3-fluoro-2-hydroxyphenyl)-2-methyl-5-phenethylpyrimidin-4-one Traditional Name: 3-ethyl-6-(3-fluoro-2-hydroxy-phenyl)-2-methyl-5-phenethyl-pyrimidin-4-one Formula: C21H21FN2O2 MolecularWeight: 352.402043

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC(=C(C1=O)CCC2=CC=CC=C2)C3=C(C(=CC=C3)F)O)C

Isomeric SMILES

CCN1C(=NC(=C(C1=O)CCC2=CC=CC=C2)C3=C(C(=CC=C3)F)O)C

InChI

InChI=1S/C21H21FN2O2/c1-3-24-14(2)23-19(16-10-7-11-18(22)20(16)25)17(21(24)26)13-12-15-8-5-4-6-9-15/h4-11,25H,3,12-13H2,1-2H3