1-cyclopropyl-7-[(1R,2S)-2-methylcyclopropyl]-4-oxidanylidene-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate

Systemtic Name: 1-cyclopropyl-7-[(1R,2S)-2-methylcyclopropyl]-4-oxidanylidene-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate Openeye Name: 1-cyclopropyl-7-[(1R,2S)-2-methylcyclopropyl]-4-oxo-5-thioxo-8H-pyrimido[4,5-d]pyrimidin-2-olate CAS Name: 1-cyclopropyl-7-[(1R,2S)-2-methylcyclopropyl]-4-oxo-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate IUPAC Name: 1-cyclopropyl-7-[(1R,2S)-2-methylcyclopropyl]-4-oxo-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate Traditional Name: 1-cyclopropyl-4-keto-7-[(1R,2S)-2-methylcyclopropyl]-5-thioxo-8H-pyrimido[4,5-d]pyrimidin-2-olate Formula: C13H13N4O2S- MolecularWeight: 289.33292

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC1C2=NC(=S)C3=C(N2)N(C(=NC3=O)[O-])C4CC4

Isomeric SMILES

C[C@H]1C[C@H]1C2=NC(=S)C3=C(N2)N(C(=NC3=O)[O-])C4CC4

InChI

InChI=1S/C13H14N4O2S/c1-5-4-7(5)9-14-10-8(12(20)15-9)11(18)16-13(19)17(10)6-2-3-6/h5-7H,2-4H2,1H3,(H,14,15,20)(H,16,18,19)/p-1/t5-,7+/m0/s1