2-bromanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one

Systemtic Name: 2-bromanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one Openeye Name: 2-bromo-1-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one CAS Name: 2-bromo-1-[4-(2-pyrimidinyl)-1-piperazinyl]-1-butanone IUPAC Name: 2-bromo-1-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-one Traditional Name: 2-bromo-1-[4-(2-pyrimidyl)piperazino]butan-1-one Formula: C12H17BrN4O MolecularWeight: 313.19358

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCN(CC1)C2=NC=CC=N2)Br

Isomeric SMILES

CCC(C(=O)N1CCN(CC1)C2=NC=CC=N2)Br

InChI

InChI=1S/C12H17BrN4O/c1-2-10(13)11(18)16-6-8-17(9-7-16)12-14-4-3-5-15-12/h3-5,10H,2,6-9H2,1H3