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

Systemtic Name: N-[5-[(3-nitro-4-oxidanyl-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanamide Openeye Name: N-[5-[(4-hydroxy-3-nitro-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]acetamide CAS Name: N-[5-[(4-hydroxy-3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]acetamide IUPAC Name: N-[5-[(4-hydroxy-3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetamide Traditional Name: N-[5-(4-hydroxy-3-nitro-benzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]acetamide Formula: C12H9N3O5S2 MolecularWeight: 339.34696

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9N3O5S2/c1-6(16)13-14-11(18)10(22-12(14)21)5-7-2-3-9(17)8(4-7)15(19)20/h2-5,17H,1H3,(H,13,16)