3-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl(methyl)amino]propanethioamide

Systemtic Name: 3-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl(methyl)amino]propanethioamide Openeye Name: 3-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl(methyl)amino]propanethioamide CAS Name: 3-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl(methyl)amino]propanethioamide IUPAC Name: 3-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl(methyl)amino]propanethioamide Traditional Name: 3-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl(methyl)amino]thiopropionamide Formula: C12H16N2O4S2 MolecularWeight: 316.39644

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=S)N)S(=O)(=O)C1=CC2=C(C=C1)OCCO2

Isomeric SMILES

CN(CCC(=S)N)S(=O)(=O)C1=CC2=C(C=C1)OCCO2

InChI

InChI=1S/C12H16N2O4S2/c1-14(5-4-12(13)19)20(15,16)9-2-3-10-11(8-9)18-7-6-17-10/h2-3,8H,4-7H2,1H3,(H2,13,19)