2-tert-butylsulfanyl-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-tert-butylsulfanyl-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-tert-butylsulfanyl-1-[4-(p-tolylsulfonyl)piperazin-1-yl]ethanone CAS Name: 2-(tert-butylthio)-1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-tert-butylsulfanyl-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-(tert-butylthio)-1-(4-tosylpiperazino)ethanone Formula: C17H26N2O3S2 MolecularWeight: 370.52994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26N2O3S2/c1-14-5-7-15(8-6-14)24(21,22)19-11-9-18(10-12-19)16(20)13-23-17(2,3)4/h5-8H,9-13H2,1-4H3