2-(4-bromanyl-2-fluoranyl-phenoxy)-1-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]ethanone

Systemtic Name: 2-(4-bromanyl-2-fluoranyl-phenoxy)-1-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]ethanone Openeye Name: 2-(4-bromo-2-fluoro-phenoxy)-1-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-yl]ethanone CAS Name: 2-(4-bromo-2-fluorophenoxy)-1-[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-bromo-2-fluorophenoxy)-1-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanone Traditional Name: 2-(4-bromo-2-fluoro-phenoxy)-1-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazino]ethanone Formula: C20H24BrFN4O2 MolecularWeight: 451.332563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)COC3=C(C=C(C=C3)Br)F

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)COC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C20H24BrFN4O2/c1-13(2)20-23-14(3)10-18(24-20)25-6-8-26(9-7-25)19(27)12-28-17-5-4-15(21)11-16(17)22/h4-5,10-11,13H,6-9,12H2,1-3H3