1-[4-(3,4-diethoxyphenyl)sulfonylpiperazin-1-yl]-2-thiophen-2-ylsulfanyl-ethanone

Systemtic Name: 1-[4-(3,4-diethoxyphenyl)sulfonylpiperazin-1-yl]-2-thiophen-2-ylsulfanyl-ethanone Openeye Name: 1-[4-(3,4-diethoxyphenyl)sulfonylpiperazin-1-yl]-2-(2-thienylsulfanyl)ethanone CAS Name: 1-[4-(3,4-diethoxyphenyl)sulfonyl-1-piperazinyl]-2-(thiophen-2-ylthio)ethanone IUPAC Name: 1-[4-(3,4-diethoxyphenyl)sulfonylpiperazin-1-yl]-2-thiophen-2-ylsulfanylethanone Traditional Name: 1-[4-(3,4-diethoxyphenyl)sulfonylpiperazino]-2-(2-thienylthio)ethanone Formula: C20H26N2O5S3 MolecularWeight: 470.62584

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CSC3=CC=CS3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CSC3=CC=CS3)OCC

InChI

InChI=1S/C20H26N2O5S3/c1-3-26-17-8-7-16(14-18(17)27-4-2)30(24,25)22-11-9-21(10-12-22)19(23)15-29-20-6-5-13-28-20/h5-8,13-14H,3-4,9-12,15H2,1-2H3