2-methylsulfanyl-8-oxidanylidene-7,9-dihydropurin-6-olate

Systemtic Name: 2-methylsulfanyl-8-oxidanylidene-7,9-dihydropurin-6-olate Openeye Name: 2-methylsulfanyl-8-oxo-7,9-dihydropurin-6-olate CAS Name: 2-(methylthio)-8-oxo-7,9-dihydropurin-6-olate IUPAC Name: 2-methylsulfanyl-8-oxo-7,9-dihydropurin-6-olate Traditional Name: 8-keto-2-(methylthio)-7,9-dihydropurin-6-olate Formula: C6H5N4O2S- MolecularWeight: 197.1945

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(C(=N1)[O-])NC(=O)N2

Isomeric SMILES

CSC1=NC2=C(C(=N1)[O-])NC(=O)N2

InChI

InChI=1S/C6H6N4O2S/c1-13-6-9-3-2(4(11)10-6)7-5(12)8-3/h1H3,(H3,7,8,9,10,11,12)/p-1