6-(1,2,3-benzothiadiazol-5-yl)-2-methylsulfanyl-pyrimidin-4-olate

Systemtic Name: 6-(1,2,3-benzothiadiazol-5-yl)-2-methylsulfanyl-pyrimidin-4-olate Openeye Name: 6-(1,2,3-benzothiadiazol-5-yl)-2-methylsulfanyl-pyrimidin-4-olate CAS Name: 6-(1,2,3-benzothiadiazol-5-yl)-2-(methylthio)-4-pyrimidinolate IUPAC Name: 6-(1,2,3-benzothiadiazol-5-yl)-2-methylsulfanylpyrimidin-4-olate Traditional Name: 6-(1,2,3-benzothiadiazol-5-yl)-2-(methylthio)pyrimidin-4-olate Formula: C11H7N4OS2- MolecularWeight: 275.32948

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=CC(=N1)[O-])C2=CC3=C(C=C2)SN=N3

Isomeric SMILES

CSC1=NC(=CC(=N1)[O-])C2=CC3=C(C=C2)SN=N3

InChI

InChI=1S/C11H8N4OS2/c1-17-11-12-7(5-10(16)13-11)6-2-3-9-8(4-6)14-15-18-9/h2-5H,1H3,(H,12,13,16)/p-1