2-(3,4-dimethylphenyl)sulfanyl-1-[4-(4-ethanoylphenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(3,4-dimethylphenyl)sulfanyl-1-[4-(4-ethanoylphenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-[4-(4-acetylphenyl)sulfonylpiperazin-1-yl]-2-(3,4-dimethylphenyl)sulfanyl-ethanone CAS Name: 1-[4-(4-acetylphenyl)sulfonyl-1-piperazinyl]-2-[(3,4-dimethylphenyl)thio]ethanone IUPAC Name: 1-[4-(4-acetylphenyl)sulfonylpiperazin-1-yl]-2-(3,4-dimethylphenyl)sulfanylethanone Traditional Name: 1-[4-(4-acetylphenyl)sulfonylpiperazino]-2-[(3,4-dimethylphenyl)thio]ethanone Formula: C22H26N2O4S2 MolecularWeight: 446.58284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O4S2/c1-16-4-7-20(14-17(16)2)29-15-22(26)23-10-12-24(13-11-23)30(27,28)21-8-5-19(6-9-21)18(3)25/h4-9,14H,10-13,15H2,1-3H3