(5E)-1-(4-fluorophenyl)-5-[(4-morpholin-4-ylphenyl)methylidene]-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: (5E)-1-(4-fluorophenyl)-5-[(4-morpholin-4-ylphenyl)methylidene]-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate Openeye Name: (5E)-1-(4-fluorophenyl)-5-[(4-morpholinophenyl)methylene]-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: (5E)-1-(4-fluorophenyl)-5-[[4-(4-morpholinyl)phenyl]methylidene]-6-oxo-2-sulfanylidene-4-pyrimidinolate IUPAC Name: (5E)-1-(4-fluorophenyl)-5-[(4-morpholin-4-ylphenyl)methylidene]-6-oxo-2-sulfanylidenepyrimidin-4-olate Traditional Name: (5E)-1-(4-fluorophenyl)-6-keto-5-(4-morpholinobenzylidene)-2-thioxo-pyrimidin-4-olate Formula: C21H17FN3O3S- MolecularWeight: 410.441383

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)C=C3C(=NC(=S)N(C3=O)C4=CC=C(C=C4)F)[O-]

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)/C=C/3\C(=NC(=S)N(C3=O)C4=CC=C(C=C4)F)[O-]

InChI

InChI=1S/C21H18FN3O3S/c22-15-3-7-17(8-4-15)25-20(27)18(19(26)23-21(25)29)13-14-1-5-16(6-2-14)24-9-11-28-12-10-24/h1-8,13H,9-12H2,(H,23,26,29)/p-1/b18-13+