(4-bromanyl-1-methyl-pyrazol-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (4-bromanyl-1-methyl-pyrazol-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (4-bromo-1-methyl-pyrazol-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: (4-bromo-1-methyl-3-pyrazolyl)-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (4-bromo-1-methylpyrazol-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (4-bromo-1-methyl-pyrazol-3-yl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C13H15BrN6O MolecularWeight: 351.2018

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)N2CCN(CC2)C3=NC=CC=N3)Br

Isomeric SMILES

CN1C=C(C(=N1)C(=O)N2CCN(CC2)C3=NC=CC=N3)Br

InChI

InChI=1S/C13H15BrN6O/c1-18-9-10(14)11(17-18)12(21)19-5-7-20(8-6-19)13-15-3-2-4-16-13/h2-4,9H,5-8H2,1H3