1-[3-[4-(1-methylpyrazol-4-yl)carbonylpiperazin-1-yl]sulfonylphenyl]ethanone

Systemtic Name: 1-[3-[4-(1-methylpyrazol-4-yl)carbonylpiperazin-1-yl]sulfonylphenyl]ethanone Openeye Name: 1-[3-[4-(1-methylpyrazole-4-carbonyl)piperazin-1-yl]sulfonylphenyl]ethanone CAS Name: 1-[3-[[4-[(1-methyl-4-pyrazolyl)-oxomethyl]-1-piperazinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[3-[4-(1-methylpyrazole-4-carbonyl)piperazin-1-yl]sulfonylphenyl]ethanone Traditional Name: 1-[3-[4-(1-methylpyrazole-4-carbonyl)piperazino]sulfonylphenyl]ethanone Formula: C17H20N4O4S MolecularWeight: 376.4301

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CN(N=C3)C

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CN(N=C3)C

InChI

InChI=1S/C17H20N4O4S/c1-13(22)14-4-3-5-16(10-14)26(24,25)21-8-6-20(7-9-21)17(23)15-11-18-19(2)12-15/h3-5,10-12H,6-9H2,1-2H3