3-(3-bromanyl-4-fluoranyl-phenyl)-1-[2-[(6-methyl-2-propan-2-yl-pyrimidin-4-yl)oxymethyl]morpholin-4-yl]prop-2-en-1-one

Systemtic Name: 3-(3-bromanyl-4-fluoranyl-phenyl)-1-[2-[(6-methyl-2-propan-2-yl-pyrimidin-4-yl)oxymethyl]morpholin-4-yl]prop-2-en-1-one Openeye Name: 3-(3-bromo-4-fluoro-phenyl)-1-[2-[(2-isopropyl-6-methyl-pyrimidin-4-yl)oxymethyl]morpholin-4-yl]prop-2-en-1-one CAS Name: 3-(3-bromo-4-fluorophenyl)-1-[2-[(6-methyl-2-propan-2-yl-4-pyrimidinyl)oxymethyl]-4-morpholinyl]-2-propen-1-one IUPAC Name: 3-(3-bromo-4-fluorophenyl)-1-[2-[(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxymethyl]morpholin-4-yl]prop-2-en-1-one Traditional Name: 3-(3-bromo-4-fluoro-phenyl)-1-[2-[(2-isopropyl-6-methyl-pyrimidin-4-yl)oxymethyl]morpholino]prop-2-en-1-one Formula: C22H25BrFN3O3 MolecularWeight: 478.354603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)OCC2CN(CCO2)C(=O)C=CC3=CC(=C(C=C3)F)Br

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)OCC2CN(CCO2)C(=O)C=CC3=CC(=C(C=C3)F)Br

InChI

InChI=1S/C22H25BrFN3O3/c1-14(2)22-25-15(3)10-20(26-22)30-13-17-12-27(8-9-29-17)21(28)7-5-16-4-6-19(24)18(23)11-16/h4-7,10-11,14,17H,8-9,12-13H2,1-3H3