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

Systemtic Name: (5Z)-5-[(2-bromanyl-4-ethoxy-5-methoxy-phenyl)methylidene]-1-(3,5-dimethylphenyl)-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate Openeye Name: (5Z)-5-[(2-bromo-4-ethoxy-5-methoxy-phenyl)methylene]-1-(3,5-dimethylphenyl)-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: (5Z)-5-[(2-bromo-4-ethoxy-5-methoxyphenyl)methylidene]-1-(3,5-dimethylphenyl)-6-oxo-2-sulfanylidene-4-pyrimidinolate IUPAC Name: (5Z)-5-[(2-bromo-4-ethoxy-5-methoxyphenyl)methylidene]-1-(3,5-dimethylphenyl)-6-oxo-2-sulfanylidenepyrimidin-4-olate Traditional Name: (5Z)-5-(2-bromo-4-ethoxy-5-methoxy-benzylidene)-1-(3,5-dimethylphenyl)-6-keto-2-thioxo-pyrimidin-4-olate Formula: C22H20BrN2O4S- MolecularWeight: 488.3742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)Br)C=C2C(=NC(=S)N(C2=O)C3=CC(=CC(=C3)C)C)[O-])OC

Isomeric SMILES

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

InChI

InChI=1S/C22H21BrN2O4S/c1-5-29-19-11-17(23)14(10-18(19)28-4)9-16-20(26)24-22(30)25(21(16)27)15-7-12(2)6-13(3)8-15/h6-11H,5H2,1-4H3,(H,24,26,30)/p-1/b16-9-