1-methyl-7-(2-methylpropyl)-4-oxidanylidene-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate

Systemtic Name: 1-methyl-7-(2-methylpropyl)-4-oxidanylidene-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate Openeye Name: 7-isobutyl-1-methyl-4-oxo-5-thioxo-8H-pyrimido[4,5-d]pyrimidin-2-olate CAS Name: 1-methyl-7-(2-methylpropyl)-4-oxo-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate IUPAC Name: 1-methyl-7-(2-methylpropyl)-4-oxo-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate Traditional Name: 7-isobutyl-4-keto-1-methyl-5-thioxo-8H-pyrimido[4,5-d]pyrimidin-2-olate Formula: C11H13N4O2S- MolecularWeight: 265.31152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NC(=S)C2=C(N1)N(C(=NC2=O)[O-])C

Isomeric SMILES

CC(C)CC1=NC(=S)C2=C(N1)N(C(=NC2=O)[O-])C

InChI

InChI=1S/C11H14N4O2S/c1-5(2)4-6-12-8-7(10(18)13-6)9(16)14-11(17)15(8)3/h5H,4H2,1-3H3,(H,12,13,18)(H,14,16,17)/p-1