2-(3,5-dimethylphenoxy)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanone

Systemtic Name: 2-(3,5-dimethylphenoxy)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanone Openeye Name: 2-(3,5-dimethylphenoxy)-1-[4-(2-thienylsulfonyl)piperazin-1-yl]ethanone CAS Name: 2-(3,5-dimethylphenoxy)-1-(4-thiophen-2-ylsulfonyl-1-piperazinyl)ethanone IUPAC Name: 2-(3,5-dimethylphenoxy)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanone Traditional Name: 2-(3,5-dimethylphenoxy)-1-[4-(2-thienylsulfonyl)piperazino]ethanone Formula: C18H22N2O4S2 MolecularWeight: 394.50828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3)C

InChI

InChI=1S/C18H22N2O4S2/c1-14-10-15(2)12-16(11-14)24-13-17(21)19-5-7-20(8-6-19)26(22,23)18-4-3-9-25-18/h3-4,9-12H,5-8,13H2,1-2H3