3-(4-bromanylpyrazol-1-yl)-2-methyl-1-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]propan-1-one

Systemtic Name: 3-(4-bromanylpyrazol-1-yl)-2-methyl-1-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]propan-1-one Openeye Name: 3-(4-bromopyrazol-1-yl)-2-methyl-1-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]propan-1-one CAS Name: 3-(4-bromo-1-pyrazolyl)-2-methyl-1-[4-[(1-methyl-4-pyrazolyl)methyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-(4-bromopyrazol-1-yl)-2-methyl-1-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]propan-1-one Traditional Name: 3-(4-bromopyrazol-1-yl)-2-methyl-1-[4-[(1-methylpyrazol-4-yl)methyl]piperazino]propan-1-one Formula: C16H23BrN6O MolecularWeight: 395.29742

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=C(C=N1)Br)C(=O)N2CCN(CC2)CC3=CN(N=C3)C

Isomeric SMILES

CC(CN1C=C(C=N1)Br)C(=O)N2CCN(CC2)CC3=CN(N=C3)C

InChI

InChI=1S/C16H23BrN6O/c1-13(9-23-12-15(17)8-19-23)16(24)22-5-3-21(4-6-22)11-14-7-18-20(2)10-14/h7-8,10,12-13H,3-6,9,11H2,1-2H3