2-(2,6-dimethylphenoxy)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanone

Systemtic Name: 2-(2,6-dimethylphenoxy)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanone Openeye Name: 2-(2,6-dimethylphenoxy)-1-[4-(2-thienylsulfonyl)piperazin-1-yl]ethanone CAS Name: 2-(2,6-dimethylphenoxy)-1-(4-thiophen-2-ylsulfonyl-1-piperazinyl)ethanone IUPAC Name: 2-(2,6-dimethylphenoxy)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanone Traditional Name: 2-(2,6-dimethylphenoxy)-1-[4-(2-thienylsulfonyl)piperazino]ethanone Formula: C18H22N2O4S2 MolecularWeight: 394.50828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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