1-[4-(2,4-dichlorophenyl)carbonylpiperazin-1-yl]-2-(2-methylphenyl)sulfanyl-ethanone

Systemtic Name: 1-[4-(2,4-dichlorophenyl)carbonylpiperazin-1-yl]-2-(2-methylphenyl)sulfanyl-ethanone Openeye Name: 1-[4-(2,4-dichlorobenzoyl)piperazin-1-yl]-2-(o-tolylsulfanyl)ethanone CAS Name: 1-[4-[(2,4-dichlorophenyl)-oxomethyl]-1-piperazinyl]-2-[(2-methylphenyl)thio]ethanone IUPAC Name: 1-[4-(2,4-dichlorobenzoyl)piperazin-1-yl]-2-(2-methylphenyl)sulfanylethanone Traditional Name: 1-[4-(2,4-dichlorobenzoyl)piperazino]-2-(o-tolylthio)ethanone Formula: C20H20Cl2N2O2S MolecularWeight: 423.356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)N2CCN(CC2)C(=O)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)N2CCN(CC2)C(=O)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H20Cl2N2O2S/c1-14-4-2-3-5-18(14)27-13-19(25)23-8-10-24(11-9-23)20(26)16-7-6-15(21)12-17(16)22/h2-7,12H,8-11,13H2,1H3