1-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-2-phenethylsulfanyl-ethanone

Systemtic Name: 1-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-2-phenethylsulfanyl-ethanone Openeye Name: 1-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-2-phenethylsulfanyl-ethanone CAS Name: 1-[4-(3-chlorophenyl)sulfonyl-1-piperazinyl]-2-(phenethylthio)ethanone IUPAC Name: 1-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-2-phenethylsulfanylethanone Traditional Name: 1-[4-(3-chlorophenyl)sulfonylpiperazino]-2-(phenethylthio)ethanone Formula: C20H23ClN2O3S2 MolecularWeight: 438.99122

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CSCCC2=CC=CC=C2)S(=O)(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

C1CN(CCN1C(=O)CSCCC2=CC=CC=C2)S(=O)(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H23ClN2O3S2/c21-18-7-4-8-19(15-18)28(25,26)23-12-10-22(11-13-23)20(24)16-27-14-9-17-5-2-1-3-6-17/h1-8,15H,9-14,16H2