2-[1,3-benzodioxol-5-ylmethylcarbamothioyl(methyl)amino]-N,N-diethyl-ethanamide

Systemtic Name: 2-[1,3-benzodioxol-5-ylmethylcarbamothioyl(methyl)amino]-N,N-diethyl-ethanamide Openeye Name: 2-[1,3-benzodioxol-5-ylmethylcarbamothioyl(methyl)amino]-N,N-diethyl-acetamide CAS Name: 2-[[(1,3-benzodioxol-5-ylmethylamino)-sulfanylidenemethyl]-methylamino]-N,N-diethylacetamide IUPAC Name: 2-[1,3-benzodioxol-5-ylmethylcarbamothioyl(methyl)amino]-N,N-diethylacetamide Traditional Name: N,N-diethyl-2-[methyl(piperonylthiocarbamoyl)amino]acetamide Formula: C16H23N3O3S MolecularWeight: 337.43712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CN(C)C(=S)NCC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCN(CC)C(=O)CN(C)C(=S)NCC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C16H23N3O3S/c1-4-19(5-2)15(20)10-18(3)16(23)17-9-12-6-7-13-14(8-12)22-11-21-13/h6-8H,4-5,9-11H2,1-3H3,(H,17,23)