1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2-(2-methylphenyl)sulfanyl-ethanone

Systemtic Name: 1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2-(2-methylphenyl)sulfanyl-ethanone Openeye Name: 1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2-(o-tolylsulfanyl)ethanone CAS Name: 1-[4-(4-bromophenyl)sulfonyl-1-piperazinyl]-2-[(2-methylphenyl)thio]ethanone IUPAC Name: 1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2-(2-methylphenyl)sulfanylethanone Traditional Name: 1-(4-brosylpiperazino)-2-(o-tolylthio)ethanone Formula: C19H21BrN2O3S2 MolecularWeight: 469.41564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H21BrN2O3S2/c1-15-4-2-3-5-18(15)26-14-19(23)21-10-12-22(13-11-21)27(24,25)17-8-6-16(20)7-9-17/h2-9H,10-14H2,1H3