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

Systemtic Name: 1-ethyl-7-(2-methylpropyl)-4-oxidanylidene-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate Openeye Name: 1-ethyl-7-isobutyl-4-oxo-5-thioxo-8H-pyrimido[4,5-d]pyrimidin-2-olate CAS Name: 1-ethyl-7-(2-methylpropyl)-4-oxo-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate IUPAC Name: 1-ethyl-7-(2-methylpropyl)-4-oxo-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate Traditional Name: 1-ethyl-7-isobutyl-4-keto-5-thioxo-8H-pyrimido[4,5-d]pyrimidin-2-olate Formula: C12H15N4O2S- MolecularWeight: 279.3381

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=O)N=C1[O-])C(=S)N=C(N2)CC(C)C

Isomeric SMILES

CCN1C2=C(C(=O)N=C1[O-])C(=S)N=C(N2)CC(C)C

InChI

InChI=1S/C12H16N4O2S/c1-4-16-9-8(10(17)15-12(16)18)11(19)14-7(13-9)5-6(2)3/h6H,4-5H2,1-3H3,(H,13,14,19)(H,15,17,18)/p-1