(5E)-5-[[1-(3-nitrophenyl)pyrrol-2-yl]methylidene]-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: (5E)-5-[[1-(3-nitrophenyl)pyrrol-2-yl]methylidene]-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate Openeye Name: (5E)-5-[[1-(3-nitrophenyl)pyrrol-2-yl]methylene]-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: (5E)-5-[[1-(3-nitrophenyl)-2-pyrrolyl]methylidene]-6-oxo-2-sulfanylidene-4-pyrimidinolate IUPAC Name: (5E)-5-[[1-(3-nitrophenyl)pyrrol-2-yl]methylidene]-6-oxo-2-sulfanylidenepyrimidin-4-olate Traditional Name: (5E)-6-keto-5-[[1-(3-nitrophenyl)pyrrol-2-yl]methylene]-2-thioxo-pyrimidin-4-olate Formula: C15H9N4O4S- MolecularWeight: 341.32136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])N2C=CC=C2C=C3C(=O)NC(=S)N=C3[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])N2C=CC=C2/C=C\3/C(=O)NC(=S)N=C3[O-]

InChI

InChI=1S/C15H10N4O4S/c20-13-12(14(21)17-15(24)16-13)8-10-5-2-6-18(10)9-3-1-4-11(7-9)19(22)23/h1-8H,(H2,16,17,20,21,24)/p-1