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

Systemtic Name: 3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-2-methyl-1-[4-(1-methylpyrazol-4-yl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-2-methyl-1-[4-(1-methylpyrazol-4-yl)sulfonylpiperazin-1-yl]propan-1-one CAS Name: 3-(4-bromo-3,5-dimethyl-1-pyrazolyl)-2-methyl-1-[4-[(1-methyl-4-pyrazolyl)sulfonyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-(4-bromo-3,5-dimethylpyrazol-1-yl)-2-methyl-1-[4-(1-methylpyrazol-4-yl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-2-methyl-1-[4-(1-methylpyrazol-4-yl)sulfonylpiperazino]propan-1-one Formula: C17H25BrN6O3S MolecularWeight: 473.3878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25BrN6O3S/c1-12(10-24-14(3)16(18)13(2)20-24)17(25)22-5-7-23(8-6-22)28(26,27)15-9-19-21(4)11-15/h9,11-12H,5-8,10H2,1-4H3