1-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-2-[(3-methylphenyl)methylsulfanyl]ethanone

Systemtic Name: 1-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-2-[(3-methylphenyl)methylsulfanyl]ethanone Openeye Name: 1-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-2-(m-tolylmethylsulfanyl)ethanone CAS Name: 1-[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]-2-[(3-methylphenyl)methylthio]ethanone IUPAC Name: 1-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-2-[(3-methylphenyl)methylsulfanyl]ethanone Traditional Name: 1-[4-(4-methoxyphenyl)sulfonylpiperazino]-2-[(3-methylbenzyl)thio]ethanone Formula: C21H26N2O4S2 MolecularWeight: 434.57214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC(=CC=C1)CSCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H26N2O4S2/c1-17-4-3-5-18(14-17)15-28-16-21(24)22-10-12-23(13-11-22)29(25,26)20-8-6-19(27-2)7-9-20/h3-9,14H,10-13,15-16H2,1-2H3