2-(1,3-benzodioxol-5-ylmethylcarbamothioylamino)-N-methyl-ethanamide

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethylcarbamothioylamino)-N-methyl-ethanamide Openeye Name: 2-(1,3-benzodioxol-5-ylmethylcarbamothioylamino)-N-methyl-acetamide CAS Name: 2-[[(1,3-benzodioxol-5-ylmethylamino)-sulfanylidenemethyl]amino]-N-methylacetamide IUPAC Name: 2-(1,3-benzodioxol-5-ylmethylcarbamothioylamino)-N-methylacetamide Traditional Name: N-methyl-2-(piperonylthiocarbamoylamino)acetamide Formula: C12H15N3O3S MolecularWeight: 281.3308

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CNC(=S)NCC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CNC(=O)CNC(=S)NCC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C12H15N3O3S/c1-13-11(16)6-15-12(19)14-5-8-2-3-9-10(4-8)18-7-17-9/h2-4H,5-7H2,1H3,(H,13,16)(H2,14,15,19)