2-[1,4-bis-(4-methylphenyl)sulfonylpiperazin-2-yl]-1-cyclohexyl-ethanone

Systemtic Name: 2-[1,4-bis-(4-methylphenyl)sulfonylpiperazin-2-yl]-1-cyclohexyl-ethanone Openeye Name: 2-[1,4-bis(p-tolylsulfonyl)piperazin-2-yl]-1-cyclohexyl-ethanone CAS Name: 2-[1,4-bis-(4-methylphenyl)sulfonyl-2-piperazinyl]-1-cyclohexylethanone IUPAC Name: 2-[1,4-bis-(4-methylphenyl)sulfonylpiperazin-2-yl]-1-cyclohexylethanone Traditional Name: 1-cyclohexyl-2-(1,4-ditosylpiperazin-2-yl)ethanone Formula: C26H34N2O5S2 MolecularWeight: 518.68856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(C(C2)CC(=O)C3CCCCC3)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(C(C2)CC(=O)C3CCCCC3)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C26H34N2O5S2/c1-20-8-12-24(13-9-20)34(30,31)27-16-17-28(35(32,33)25-14-10-21(2)11-15-25)23(19-27)18-26(29)22-6-4-3-5-7-22/h8-15,22-23H,3-7,16-19H2,1-2H3