2-(2-methylphenoxy)-N-(6-piperidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-(2-methylphenoxy)-N-(6-piperidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-(2-methylphenoxy)-N-[6-(1-piperidylsulfonyl)-1,3-benzothiazol-2-yl]acetamide CAS Name: 2-(2-methylphenoxy)-N-[6-(1-piperidinylsulfonyl)-1,3-benzothiazol-2-yl]acetamide IUPAC Name: 2-(2-methylphenoxy)-N-(6-piperidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-(2-methylphenoxy)-N-(6-piperidinosulfonyl-1,3-benzothiazol-2-yl)acetamide Formula: C21H23N3O4S2 MolecularWeight: 445.55502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=CC=CC=C1OCC(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C21H23N3O4S2/c1-15-7-3-4-8-18(15)28-14-20(25)23-21-22-17-10-9-16(13-19(17)29-21)30(26,27)24-11-5-2-6-12-24/h3-4,7-10,13H,2,5-6,11-12,14H2,1H3,(H,22,23,25)