1-[4-(1-methylpyrazol-4-yl)sulfonylpiperazin-1-yl]-3-(phenylsulfonyl)propan-1-one

Systemtic Name: 1-[4-(1-methylpyrazol-4-yl)sulfonylpiperazin-1-yl]-3-(phenylsulfonyl)propan-1-one Openeye Name: 3-(benzenesulfonyl)-1-[4-(1-methylpyrazol-4-yl)sulfonylpiperazin-1-yl]propan-1-one CAS Name: 3-(benzenesulfonyl)-1-[4-[(1-methyl-4-pyrazolyl)sulfonyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-(benzenesulfonyl)-1-[4-(1-methylpyrazol-4-yl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 3-besyl-1-[4-(1-methylpyrazol-4-yl)sulfonylpiperazino]propan-1-one Formula: C17H22N4O5S2 MolecularWeight: 426.51038

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)S(=O)(=O)N2CCN(CC2)C(=O)CCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN1C=C(C=N1)S(=O)(=O)N2CCN(CC2)C(=O)CCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H22N4O5S2/c1-19-14-16(13-18-19)28(25,26)21-10-8-20(9-11-21)17(22)7-12-27(23,24)15-5-3-2-4-6-15/h2-6,13-14H,7-12H2,1H3