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

Systemtic Name: 3-(4-methylphenyl)sulfonyl-1-[4-(1-methylpyrazol-4-yl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 1-[4-(1-methylpyrazol-4-yl)sulfonylpiperazin-1-yl]-3-(p-tolylsulfonyl)propan-1-one CAS Name: 3-(4-methylphenyl)sulfonyl-1-[4-[(1-methyl-4-pyrazolyl)sulfonyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-(4-methylphenyl)sulfonyl-1-[4-(1-methylpyrazol-4-yl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 1-[4-(1-methylpyrazol-4-yl)sulfonylpiperazino]-3-tosyl-propan-1-one Formula: C18H24N4O5S2 MolecularWeight: 440.53696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CN(N=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CN(N=C3)C

InChI

InChI=1S/C18H24N4O5S2/c1-15-3-5-16(6-4-15)28(24,25)12-7-18(23)21-8-10-22(11-9-21)29(26,27)17-13-19-20(2)14-17/h3-6,13-14H,7-12H2,1-2H3