2-(4-bromanyl-2-chloranyl-phenoxy)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-(4-bromanyl-2-chloranyl-phenoxy)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-(4-bromo-2-chloro-phenoxy)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-(4-bromo-2-chlorophenoxy)-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-bromo-2-chlorophenoxy)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-(4-bromo-2-chloro-phenoxy)-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C16H16BrClN4O2 MolecularWeight: 411.68084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16BrClN4O2/c17-12-2-3-14(13(18)10-12)24-11-15(23)21-6-8-22(9-7-21)16-19-4-1-5-20-16/h1-5,10H,6-9,11H2