(5Z)-5-[(5-bromanyl-2,4-diethoxy-phenyl)methylidene]-1-(3-fluorophenyl)-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: (5Z)-5-[(5-bromanyl-2,4-diethoxy-phenyl)methylidene]-1-(3-fluorophenyl)-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate Openeye Name: (5Z)-5-[(5-bromo-2,4-diethoxy-phenyl)methylene]-1-(3-fluorophenyl)-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: (5Z)-5-[(5-bromo-2,4-diethoxyphenyl)methylidene]-1-(3-fluorophenyl)-6-oxo-2-sulfanylidene-4-pyrimidinolate IUPAC Name: (5Z)-5-[(5-bromo-2,4-diethoxyphenyl)methylidene]-1-(3-fluorophenyl)-6-oxo-2-sulfanylidenepyrimidin-4-olate Traditional Name: (5Z)-5-(5-bromo-2,4-diethoxy-benzylidene)-1-(3-fluorophenyl)-6-keto-2-thioxo-pyrimidin-4-olate Formula: C21H17BrFN2O4S- MolecularWeight: 492.338083

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1C=C2C(=NC(=S)N(C2=O)C3=CC(=CC=C3)F)[O-])Br)OCC

Isomeric SMILES

CCOC1=CC(=C(C=C1/C=C\2/C(=NC(=S)N(C2=O)C3=CC(=CC=C3)F)[O-])Br)OCC

InChI

InChI=1S/C21H18BrFN2O4S/c1-3-28-17-11-18(29-4-2)16(22)9-12(17)8-15-19(26)24-21(30)25(20(15)27)14-7-5-6-13(23)10-14/h5-11H,3-4H2,1-2H3,(H,24,26,30)/p-1/b15-8-