N-[5-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanamide

Systemtic Name: N-[5-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanamide Openeye Name: N-[5-[(6-nitro-1,3-benzodioxol-5-yl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]acetamide CAS Name: N-[5-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]acetamide IUPAC Name: N-[5-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetamide Traditional Name: N-[4-keto-5-[(6-nitro-1,3-benzodioxol-5-yl)methylene]-2-thioxo-thiazolidin-3-yl]acetamide Formula: C13H9N3O6S2 MolecularWeight: 367.35706

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NN1C(=O)C(=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3)SC1=S

Isomeric SMILES

CC(=O)NN1C(=O)C(=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3)SC1=S

InChI

InChI=1S/C13H9N3O6S2/c1-6(17)14-15-12(18)11(24-13(15)23)3-7-2-9-10(22-5-21-9)4-8(7)16(19)20/h2-4H,5H2,1H3,(H,14,17)