(5E)-6-oxidanylidene-5-[(5-phenyl-1H-pyrazol-4-yl)methylidene]-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: (5E)-6-oxidanylidene-5-[(5-phenyl-1H-pyrazol-4-yl)methylidene]-2-sulfanylidene-pyrimidin-4-olate Openeye Name: (5E)-6-oxo-5-[(5-phenyl-1H-pyrazol-4-yl)methylene]-2-thioxo-pyrimidin-4-olate CAS Name: (5E)-6-oxo-5-[(5-phenyl-1H-pyrazol-4-yl)methylidene]-2-sulfanylidene-4-pyrimidinolate IUPAC Name: (5E)-6-oxo-5-[(5-phenyl-1H-pyrazol-4-yl)methylidene]-2-sulfanylidenepyrimidin-4-olate Traditional Name: (5E)-6-keto-5-[(5-phenyl-1H-pyrazol-4-yl)methylene]-2-thioxo-pyrimidin-4-olate Formula: C14H9N4O2S- MolecularWeight: 297.31186

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C=NN2)C=C3C(=O)NC(=S)N=C3[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C=NN2)/C=C\3/C(=O)NC(=S)N=C3[O-]

InChI

InChI=1S/C14H10N4O2S/c19-12-10(13(20)17-14(21)16-12)6-9-7-15-18-11(9)8-4-2-1-3-5-8/h1-7H,(H,15,18)(H2,16,17,19,20,21)/p-1