2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]-1-[4-(phenylsulfonyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]-1-[4-(phenylsulfonyl)piperazin-1-yl]ethanone Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]ethanone CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-2-[methyl-[[4-(methylthio)phenyl]methyl]amino]ethanone IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]ethanone Traditional Name: 1-(4-besylpiperazino)-2-[methyl-[4-(methylthio)benzyl]amino]ethanone Formula: C21H27N3O3S2 MolecularWeight: 433.58738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O3S2/c1-22(16-18-8-10-19(28-2)11-9-18)17-21(25)23-12-14-24(15-13-23)29(26,27)20-6-4-3-5-7-20/h3-11H,12-17H2,1-2H3