(5E)-5-[[2-(2-nitrophenyl)sulfonyloxyphenyl]methylidene]-2-sulfanylidene-1,3-thiazol-4-olate

Systemtic Name: (5E)-5-[[2-(2-nitrophenyl)sulfonyloxyphenyl]methylidene]-2-sulfanylidene-1,3-thiazol-4-olate Openeye Name: (5E)-5-[[2-(2-nitrophenyl)sulfonyloxyphenyl]methylene]-2-thioxo-thiazol-4-olate CAS Name: (5E)-5-[[2-(2-nitrophenyl)sulfonyloxyphenyl]methylidene]-2-sulfanylidene-4-thiazololate IUPAC Name: (5E)-5-[[2-(2-nitrophenyl)sulfonyloxyphenyl]methylidene]-2-sulfanylidene-1,3-thiazol-4-olate Traditional Name: (5E)-5-[2-(2-nitrophenyl)sulfonyloxybenzylidene]-2-thioxo-3-thiazolin-4-olate Formula: C16H9N2O6S3- MolecularWeight: 421.44746

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10N2O6S3/c19-15-13(26-16(25)17-15)9-10-5-1-3-7-12(10)24-27(22,23)14-8-4-2-6-11(14)18(20)21/h1-9H,(H,17,19,25)/p-1/b13-9+