1-[4-[4-(4-methyl-3-methylsulfonyl-phenyl)carbonylpiperazin-1-yl]sulfonylphenyl]ethanone

Systemtic Name: 1-[4-[4-(4-methyl-3-methylsulfonyl-phenyl)carbonylpiperazin-1-yl]sulfonylphenyl]ethanone Openeye Name: 1-[4-[4-(4-methyl-3-methylsulfonyl-benzoyl)piperazin-1-yl]sulfonylphenyl]ethanone CAS Name: 1-[4-[[4-[(4-methyl-3-methylsulfonylphenyl)-oxomethyl]-1-piperazinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[4-[4-(4-methyl-3-methylsulfonylbenzoyl)piperazin-1-yl]sulfonylphenyl]ethanone Traditional Name: 1-[4-[4-(3-mesyl-4-methyl-benzoyl)piperazino]sulfonylphenyl]ethanone Formula: C21H24N2O6S2 MolecularWeight: 464.55506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O6S2/c1-15-4-5-18(14-20(15)30(3,26)27)21(25)22-10-12-23(13-11-22)31(28,29)19-8-6-17(7-9-19)16(2)24/h4-9,14H,10-13H2,1-3H3