1,3,7-trimethyl-2-oxidanylidene-5-sulfanylidene-pyrimido[4,5-d]pyrimidin-4-olate

Systemtic Name: 1,3,7-trimethyl-2-oxidanylidene-5-sulfanylidene-pyrimido[4,5-d]pyrimidin-4-olate Openeye Name: 1,3,7-trimethyl-2-oxo-5-thioxo-pyrimido[4,5-d]pyrimidin-4-olate CAS Name: 1,3,7-trimethyl-2-oxo-5-sulfanylidene-4-pyrimido[4,5-d]pyrimidinolate IUPAC Name: 1,3,7-trimethyl-2-oxo-5-sulfanylidenepyrimido[4,5-d]pyrimidin-4-olate Traditional Name: 2-keto-1,3,7-trimethyl-5-thioxo-pyrimido[4,5-d]pyrimidin-4-olate Formula: C9H9N4O2S- MolecularWeight: 237.25836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=S)C2=C(N(C(=O)N(C2=N1)C)C)[O-]

Isomeric SMILES

CC1=NC(=S)C2=C(N(C(=O)N(C2=N1)C)C)[O-]

InChI

InChI=1S/C9H10N4O2S/c1-4-10-6-5(7(16)11-4)8(14)13(3)9(15)12(6)2/h14H,1-3H3/p-1