2-methylsulfanyl-6-quinoxalin-6-yl-pyrimidin-4-olate

Systemtic Name: 2-methylsulfanyl-6-quinoxalin-6-yl-pyrimidin-4-olate Openeye Name: 2-methylsulfanyl-6-quinoxalin-6-yl-pyrimidin-4-olate CAS Name: 2-(methylthio)-6-(6-quinoxalinyl)-4-pyrimidinolate IUPAC Name: 2-methylsulfanyl-6-quinoxalin-6-ylpyrimidin-4-olate Traditional Name: 2-(methylthio)-6-quinoxalin-6-yl-pyrimidin-4-olate Formula: C13H9N4OS- MolecularWeight: 269.30176

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=CC(=N1)[O-])C2=CC3=NC=CN=C3C=C2

Isomeric SMILES

CSC1=NC(=CC(=N1)[O-])C2=CC3=NC=CN=C3C=C2

InChI

InChI=1S/C13H10N4OS/c1-19-13-16-10(7-12(18)17-13)8-2-3-9-11(6-8)15-5-4-14-9/h2-7H,1H3,(H,16,17,18)/p-1