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

Systemtic Name: 1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2-tert-butylsulfanyl-ethanone Openeye Name: 1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2-tert-butylsulfanyl-ethanone CAS Name: 1-[4-(4-bromophenyl)sulfonyl-1-piperazinyl]-2-(tert-butylthio)ethanone IUPAC Name: 1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2-tert-butylsulfanylethanone Traditional Name: 1-(4-brosylpiperazino)-2-(tert-butylthio)ethanone Formula: C16H23BrN2O3S2 MolecularWeight: 435.39942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)(C)SCC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C16H23BrN2O3S2/c1-16(2,3)23-12-15(20)18-8-10-19(11-9-18)24(21,22)14-6-4-13(17)5-7-14/h4-7H,8-12H2,1-3H3