2-[4-(2-hydroxyethyl)piperazin-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-[4-(2-hydroxyethyl)piperazin-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[4-(2-hydroxyethyl)piperazin-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[4-(2-hydroxyethyl)-1-piperazinyl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-[4-(2-hydroxyethyl)piperazin-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[4-(2-hydroxyethyl)piperazino]-N-(6-mesyl-1,3-benzothiazol-2-yl)acetamide Formula: C16H22N4O4S2 MolecularWeight: 398.50028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CN3CCN(CC3)CCO

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CN3CCN(CC3)CCO

InChI

InChI=1S/C16H22N4O4S2/c1-26(23,24)12-2-3-13-14(10-12)25-16(17-13)18-15(22)11-20-6-4-19(5-7-20)8-9-21/h2-3,10,21H,4-9,11H2,1H3,(H,17,18,22)