methyl N-(1,3-benzodioxol-5-ylmethylcarbamothioylamino)carbamate

Systemtic Name: methyl N-(1,3-benzodioxol-5-ylmethylcarbamothioylamino)carbamate Openeye Name: methyl N-(1,3-benzodioxol-5-ylmethylcarbamothioylamino)carbamate CAS Name: N-[[(1,3-benzodioxol-5-ylmethylamino)-sulfanylidenemethyl]amino]carbamic acid methyl ester IUPAC Name: methyl N-(1,3-benzodioxol-5-ylmethylcarbamothioylamino)carbamate Traditional Name: N-(piperonylthiocarbamoylamino)carbamic acid methyl ester Formula: C11H13N3O4S MolecularWeight: 283.30362

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NNC(=S)NCC1=CC2=C(C=C1)OCO2

Isomeric SMILES

COC(=O)NNC(=S)NCC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C11H13N3O4S/c1-16-11(15)14-13-10(19)12-5-7-2-3-8-9(4-7)18-6-17-8/h2-4H,5-6H2,1H3,(H,14,15)(H2,12,13,19)