3-[(2-oxidanylidene-1,3-benzoxathiol-6-yl)oxy]propanethioamide

Systemtic Name: 3-[(2-oxidanylidene-1,3-benzoxathiol-6-yl)oxy]propanethioamide Openeye Name: 3-[(2-oxo-1,3-benzoxathiol-6-yl)oxy]propanethioamide CAS Name: 3-[(2-oxo-1,3-benzoxathiol-6-yl)oxy]propanethioamide IUPAC Name: 3-[(2-oxo-1,3-benzoxathiol-6-yl)oxy]propanethioamide Traditional Name: 3-[(2-keto-1,3-benzoxathiol-6-yl)oxy]thiopropionamide Formula: C10H9NO3S2 MolecularWeight: 255.31336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1OCCC(=S)N)OC(=O)S2

Isomeric SMILES

C1=CC2=C(C=C1OCCC(=S)N)OC(=O)S2

InChI

InChI=1S/C10H9NO3S2/c11-9(15)3-4-13-6-1-2-8-7(5-6)14-10(12)16-8/h1-2,5H,3-4H2,(H2,11,15)