2-(4-bromanyl-2-fluoranyl-phenoxy)-1-[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]ethanone

Systemtic Name: 2-(4-bromanyl-2-fluoranyl-phenoxy)-1-[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]ethanone Openeye Name: 2-(4-bromo-2-fluoro-phenoxy)-1-[4-(5-bromopyrimidin-2-yl)piperazin-1-yl]ethanone CAS Name: 2-(4-bromo-2-fluorophenoxy)-1-[4-(5-bromo-2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-bromo-2-fluorophenoxy)-1-[4-(5-bromopyrimidin-2-yl)piperazin-1-yl]ethanone Traditional Name: 2-(4-bromo-2-fluoro-phenoxy)-1-[4-(5-bromopyrimidin-2-yl)piperazino]ethanone Formula: C16H15Br2FN4O2 MolecularWeight: 474.122303

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=N2)Br)C(=O)COC3=C(C=C(C=C3)Br)F

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=N2)Br)C(=O)COC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C16H15Br2FN4O2/c17-11-1-2-14(13(19)7-11)25-10-15(24)22-3-5-23(6-4-22)16-20-8-12(18)9-21-16/h1-2,7-9H,3-6,10H2