2-[3-(4-methoxyphenoxy)propylsulfanyl]-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-[3-(4-methoxyphenoxy)propylsulfanyl]-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-[3-(4-methoxyphenoxy)propylsulfanyl]-1-[4-(p-tolylsulfonyl)piperazin-1-yl]ethanone CAS Name: 2-[3-(4-methoxyphenoxy)propylthio]-1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-[3-(4-methoxyphenoxy)propylsulfanyl]-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-[3-(4-methoxyphenoxy)propylthio]-1-(4-tosylpiperazino)ethanone Formula: C23H30N2O5S2 MolecularWeight: 478.6247

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CSCCCOC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CSCCCOC3=CC=C(C=C3)OC

InChI

InChI=1S/C23H30N2O5S2/c1-19-4-10-22(11-5-19)32(27,28)25-14-12-24(13-15-25)23(26)18-31-17-3-16-30-21-8-6-20(29-2)7-9-21/h4-11H,3,12-18H2,1-2H3