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

Systemtic Name: 3-(4-bromanylpyrazol-1-yl)-2-methyl-1-[4-(1-methylpyrazol-4-yl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 3-(4-bromopyrazol-1-yl)-2-methyl-1-[4-(1-methylpyrazol-4-yl)sulfonylpiperazin-1-yl]propan-1-one CAS Name: 3-(4-bromo-1-pyrazolyl)-2-methyl-1-[4-[(1-methyl-4-pyrazolyl)sulfonyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-(4-bromopyrazol-1-yl)-2-methyl-1-[4-(1-methylpyrazol-4-yl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 3-(4-bromopyrazol-1-yl)-2-methyl-1-[4-(1-methylpyrazol-4-yl)sulfonylpiperazino]propan-1-one Formula: C15H21BrN6O3S MolecularWeight: 445.33464

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21BrN6O3S/c1-12(9-21-10-13(16)7-18-21)15(23)20-3-5-22(6-4-20)26(24,25)14-8-17-19(2)11-14/h7-8,10-12H,3-6,9H2,1-2H3