2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)-N-(2,4,4-trimethylpentan-2-yl)ethanamide

Systemtic Name: 2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)-N-(2,4,4-trimethylpentan-2-yl)ethanamide Openeye Name: N-(1,1,3,3-tetramethylbutyl)-2-[4-(2-thienylsulfonyl)piperazin-1-yl]acetamide CAS Name: 2-(4-thiophen-2-ylsulfonyl-1-piperazinyl)-N-(2,4,4-trimethylpentan-2-yl)acetamide IUPAC Name: 2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)-N-(2,4,4-trimethylpentan-2-yl)acetamide Traditional Name: N-(1,1,3,3-tetramethylbutyl)-2-[4-(2-thienylsulfonyl)piperazino]acetamide Formula: C18H31N3O3S2 MolecularWeight: 401.58704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CS2

Isomeric SMILES

CC(C)(C)CC(C)(C)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C18H31N3O3S2/c1-17(2,3)14-18(4,5)19-15(22)13-20-8-10-21(11-9-20)26(23,24)16-7-6-12-25-16/h6-7,12H,8-11,13-14H2,1-5H3,(H,19,22)