2-[(5E)-5-[(3-bromanyl-5-nitro-2-oxidanidyl-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoate

Systemtic Name: 2-[(5E)-5-[(3-bromanyl-5-nitro-2-oxidanidyl-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoate Openeye Name: 2-[(5E)-5-[(3-bromo-5-nitro-2-oxido-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]acetate CAS Name: 2-[(5E)-5-[(3-bromo-5-nitro-2-oxidophenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]acetate IUPAC Name: 2-[(5E)-5-[(3-bromo-5-nitro-2-oxidophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetate Traditional Name: 2-[(5E)-5-(3-bromo-5-nitro-2-oxido-benzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]acetate Formula: C12H5BrN2O6S2-2 MolecularWeight: 417.2119

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Br)[O-])C=C2C(=O)N(C(=S)S2)CC(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C(C(=C1Br)[O-])/C=C/2\C(=O)N(C(=S)S2)CC(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H7BrN2O6S2/c13-7-3-6(15(20)21)1-5(10(7)18)2-8-11(19)14(4-9(16)17)12(22)23-8/h1-3,18H,4H2,(H,16,17)/p-2/b8-2+