3-[(5E)-5-[(2-nitrophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoate

Systemtic Name: 3-[(5E)-5-[(2-nitrophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoate Openeye Name: 3-[(5E)-5-[(2-nitrophenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]benzoate CAS Name: 3-[(5E)-5-[(2-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]benzoate IUPAC Name: 3-[(5E)-5-[(2-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoate Traditional Name: 3-[(5E)-4-keto-5-(2-nitrobenzylidene)-2-thioxo-thiazolidin-3-yl]benzoate Formula: C17H9N2O5S2- MolecularWeight: 385.39376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=C2C(=O)N(C(=S)S2)C3=CC=CC(=C3)C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)/C=C/2\C(=O)N(C(=S)S2)C3=CC=CC(=C3)C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H10N2O5S2/c20-15-14(9-10-4-1-2-7-13(10)19(23)24)26-17(25)18(15)12-6-3-5-11(8-12)16(21)22/h1-9H,(H,21,22)/p-1/b14-9+