5-bromanyl-2-(3-fluoranyl-2-phenylmethoxy-phenyl)-6-methyl-3-phenethyl-pyrimidin-4-one

Systemtic Name: 5-bromanyl-2-(3-fluoranyl-2-phenylmethoxy-phenyl)-6-methyl-3-phenethyl-pyrimidin-4-one Openeye Name: 2-(2-benzyloxy-3-fluoro-phenyl)-5-bromo-6-methyl-3-phenethyl-pyrimidin-4-one CAS Name: 5-bromo-2-(3-fluoro-2-phenylmethoxyphenyl)-6-methyl-3-phenethyl-4-pyrimidinone IUPAC Name: 5-bromo-2-(3-fluoro-2-phenylmethoxyphenyl)-6-methyl-3-phenethylpyrimidin-4-one Traditional Name: 2-(2-benzoxy-3-fluoro-phenyl)-5-bromo-6-methyl-3-phenethyl-pyrimidin-4-one Formula: C26H22BrFN2O2 MolecularWeight: 493.367483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=N1)C2=C(C(=CC=C2)F)OCC3=CC=CC=C3)CCC4=CC=CC=C4)Br

Isomeric SMILES

CC1=C(C(=O)N(C(=N1)C2=C(C(=CC=C2)F)OCC3=CC=CC=C3)CCC4=CC=CC=C4)Br

InChI

InChI=1S/C26H22BrFN2O2/c1-18-23(27)26(31)30(16-15-19-9-4-2-5-10-19)25(29-18)21-13-8-14-22(28)24(21)32-17-20-11-6-3-7-12-20/h2-14H,15-17H2,1H3