2-[2-(4-ethoxyphenoxy)ethylsulfanyl]-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCCSCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)OCCSCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C

InChI

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