(5E)-1-(3-bromophenyl)-5-[(3-chloranyl-4-oxidanidyl-phenyl)methylidene]-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: (5E)-1-(3-bromophenyl)-5-[(3-chloranyl-4-oxidanidyl-phenyl)methylidene]-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate Openeye Name: (5E)-1-(3-bromophenyl)-5-[(3-chloro-4-oxido-phenyl)methylene]-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: (5E)-1-(3-bromophenyl)-5-[(3-chloro-4-oxidophenyl)methylidene]-6-oxo-2-sulfanylidene-4-pyrimidinolate IUPAC Name: (5E)-1-(3-bromophenyl)-5-[(3-chloro-4-oxidophenyl)methylidene]-6-oxo-2-sulfanylidenepyrimidin-4-olate Traditional Name: (5E)-1-(3-bromophenyl)-5-(3-chloro-4-oxido-benzylidene)-6-keto-2-thioxo-pyrimidin-4-olate Formula: C17H8BrClN2O3S-2 MolecularWeight: 435.67902

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)N2C(=O)C(=CC3=CC(=C(C=C3)[O-])Cl)C(=NC2=S)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Br)N2C(=O)/C(=C/C3=CC(=C(C=C3)[O-])Cl)/C(=NC2=S)[O-]

InChI

InChI=1S/C17H10BrClN2O3S/c18-10-2-1-3-11(8-10)21-16(24)12(15(23)20-17(21)25)6-9-4-5-14(22)13(19)7-9/h1-8,22H,(H,20,23,25)/p-2/b12-6+