(5E)-5-[[3,5-bis(bromanyl)-2-oxidanidyl-phenyl]methylidene]-6-oxidanylidene-1-prop-2-enyl-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: (5E)-5-[[3,5-bis(bromanyl)-2-oxidanidyl-phenyl]methylidene]-6-oxidanylidene-1-prop-2-enyl-2-sulfanylidene-pyrimidin-4-olate Openeye Name: (5E)-1-allyl-5-[(3,5-dibromo-2-oxido-phenyl)methylene]-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: (5E)-5-[(3,5-dibromo-2-oxidophenyl)methylidene]-6-oxo-1-prop-2-enyl-2-sulfanylidene-4-pyrimidinolate IUPAC Name: (5E)-5-[(3,5-dibromo-2-oxidophenyl)methylidene]-6-oxo-1-prop-2-enyl-2-sulfanylidenepyrimidin-4-olate Traditional Name: (5E)-1-allyl-5-(3,5-dibromo-2-oxido-benzylidene)-6-keto-2-thioxo-pyrimidin-4-olate Formula: C14H8Br2N2O3S-2 MolecularWeight: 444.09792

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C(=CC2=CC(=CC(=C2[O-])Br)Br)C(=NC1=S)[O-]

Isomeric SMILES

C=CCN1C(=O)/C(=C/C2=CC(=CC(=C2[O-])Br)Br)/C(=NC1=S)[O-]

InChI

InChI=1S/C14H10Br2N2O3S/c1-2-3-18-13(21)9(12(20)17-14(18)22)5-7-4-8(15)6-10(16)11(7)19/h2,4-6,19H,1,3H2,(H,17,20,22)/p-2/b9-5+