3-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]propanethioamide

Systemtic Name: 3-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]propanethioamide Openeye Name: 3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanethioamide CAS Name: 3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanethioamide IUPAC Name: 3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanethioamide Traditional Name: 3-(1,1,3-triketo-1,2-benzothiazol-2-yl)thiopropionamide Formula: C10H10N2O3S2 MolecularWeight: 270.328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(S2(=O)=O)CCC(=S)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(S2(=O)=O)CCC(=S)N

InChI

InChI=1S/C10H10N2O3S2/c11-9(16)5-6-12-10(13)7-3-1-2-4-8(7)17(12,14)15/h1-4H,5-6H2,(H2,11,16)