(5E)-1-(4-bromophenyl)-5-[(3-nitro-4-oxidanidyl-phenyl)methylidene]-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: (5E)-1-(4-bromophenyl)-5-[(3-nitro-4-oxidanidyl-phenyl)methylidene]-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate Openeye Name: (5E)-1-(4-bromophenyl)-5-[(3-nitro-4-oxido-phenyl)methylene]-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: (5E)-1-(4-bromophenyl)-5-[(3-nitro-4-oxidophenyl)methylidene]-6-oxo-2-sulfanylidene-4-pyrimidinolate IUPAC Name: (5E)-1-(4-bromophenyl)-5-[(3-nitro-4-oxidophenyl)methylidene]-6-oxo-2-sulfanylidenepyrimidin-4-olate Traditional Name: (5E)-1-(4-bromophenyl)-6-keto-5-(3-nitro-4-oxido-benzylidene)-2-thioxo-pyrimidin-4-olate Formula: C17H8BrN3O5S-2 MolecularWeight: 446.23152

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=O)C(=CC3=CC(=C(C=C3)[O-])[N+](=O)[O-])C(=NC2=S)[O-])Br

Isomeric SMILES

C1=CC(=CC=C1N2C(=O)/C(=C/C3=CC(=C(C=C3)[O-])[N+](=O)[O-])/C(=NC2=S)[O-])Br

InChI

InChI=1S/C17H10BrN3O5S/c18-10-2-4-11(5-3-10)20-16(24)12(15(23)19-17(20)27)7-9-1-6-14(22)13(8-9)21(25)26/h1-8,22H,(H,19,23,27)/p-2/b12-7+