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

Systemtic Name: 2-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-N-(2,1,3-benzothiadiazol-4-yl)ethanamide Openeye Name: 2-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-N-(2,1,3-benzothiadiazol-4-yl)acetamide CAS Name: 2-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-N-(2,1,3-benzothiadiazol-4-yl)acetamide IUPAC Name: 2-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-N-(2,1,3-benzothiadiazol-4-yl)acetamide Traditional Name: 2-[cyclopentyl(piperonyl)amino]-N-piazthiol-4-yl-acetamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N(CC2=CC3=C(C=C2)OCO3)CC(=O)NC4=CC=CC5=NSN=C54

Isomeric SMILES

C1CCC(C1)N(CC2=CC3=C(C=C2)OCO3)CC(=O)NC4=CC=CC5=NSN=C54

InChI

InChI=1S/C21H22N4O3S/c26-20(22-16-6-3-7-17-21(16)24-29-23-17)12-25(15-4-1-2-5-15)11-14-8-9-18-19(10-14)28-13-27-18/h3,6-10,15H,1-2,4-5,11-13H2,(H,22,26)