N-[2-(1,3-benzodioxol-5-ylcarbamothioylamino)ethyl]ethanamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylcarbamothioylamino)ethyl]ethanamide Openeye Name: N-[2-(1,3-benzodioxol-5-ylcarbamothioylamino)ethyl]acetamide CAS Name: N-[2-[[(1,3-benzodioxol-5-ylamino)-sulfanylidenemethyl]amino]ethyl]acetamide IUPAC Name: N-[2-(1,3-benzodioxol-5-ylcarbamothioylamino)ethyl]acetamide Traditional Name: N-[2-(1,3-benzodioxol-5-ylthiocarbamoylamino)ethyl]acetamide Formula: C12H15N3O3S MolecularWeight: 281.3308

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC(=S)NC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CC(=O)NCCNC(=S)NC1=CC2=C(C=C1)OCO2

InChI

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