2-(2-chlorophenyl)sulfanyl-1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(2-chlorophenyl)sulfanyl-1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-(2-chlorophenyl)sulfanyl-1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 2-[(2-chlorophenyl)thio]-1-[4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-(2-chlorophenyl)sulfanyl-1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-[(2-chlorophenyl)thio]-1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazino]ethanone Formula: C20H23ClN2O5S2 MolecularWeight: 470.99002

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CSC3=CC=CC=C3Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CSC3=CC=CC=C3Cl)OC

InChI

InChI=1S/C20H23ClN2O5S2/c1-27-17-8-7-15(13-18(17)28-2)30(25,26)23-11-9-22(10-12-23)20(24)14-29-19-6-4-3-5-16(19)21/h3-8,13H,9-12,14H2,1-2H3