2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(2,1,3-benzothiadiazol-4-yl)ethanamide

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(2,1,3-benzothiadiazol-4-yl)ethanamide Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(2,1,3-benzothiadiazol-4-yl)acetamide CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-N-(2,1,3-benzothiadiazol-4-yl)acetamide IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(2,1,3-benzothiadiazol-4-yl)acetamide Traditional Name: N-piazthiol-4-yl-2-(4-piperonylpiperazino)acetamide Formula: C20H21N5O3S MolecularWeight: 411.47744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC(=O)NC4=CC=CC5=NSN=C54

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC(=O)NC4=CC=CC5=NSN=C54

InChI

InChI=1S/C20H21N5O3S/c26-19(21-15-2-1-3-16-20(15)23-29-22-16)12-25-8-6-24(7-9-25)11-14-4-5-17-18(10-14)28-13-27-17/h1-5,10H,6-9,11-13H2,(H,21,26)