3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-2-methyl-1-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]propan-1-one

Systemtic Name: 3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-2-methyl-1-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]propan-1-one Openeye Name: 3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-2-methyl-1-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]propan-1-one CAS Name: 3-(4-bromo-3,5-dimethyl-1-pyrazolyl)-2-methyl-1-[4-[(1-methyl-4-pyrazolyl)methyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-(4-bromo-3,5-dimethylpyrazol-1-yl)-2-methyl-1-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]propan-1-one Traditional Name: 3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-2-methyl-1-[4-[(1-methylpyrazol-4-yl)methyl]piperazino]propan-1-one Formula: C18H27BrN6O MolecularWeight: 423.35058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(C)C(=O)N2CCN(CC2)CC3=CN(N=C3)C)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC(C)C(=O)N2CCN(CC2)CC3=CN(N=C3)C)C)Br

InChI

InChI=1S/C18H27BrN6O/c1-13(10-25-15(3)17(19)14(2)21-25)18(26)24-7-5-23(6-8-24)12-16-9-20-22(4)11-16/h9,11,13H,5-8,10,12H2,1-4H3