copper 1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one sulfate

Systemtic Name: copper 1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one sulfate Openeye Name: copper 1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one sulfate CAS Name: copper 1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one sulfate IUPAC Name: copper 1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one sulfate Traditional Name: cupric 1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one sulfate Formula: C10H8CuN8O6S MolecularWeight: 431.83152

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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C(=NC=NC2=O)NN1.C1=C2C(=NC=NC2=O)NN1.[O-]S(=O)(=O)[O-].[Cu+2]

Isomeric SMILES

C1=C2C(=NC=NC2=O)NN1.C1=C2C(=NC=NC2=O)NN1.[O-]S(=O)(=O)[O-].[Cu+2]

InChI

InChI=1S/2C5H4N4O.Cu.H2O4S/c2*10-5-3-1-8-9-4(3)6-2-7-5;;1-5(2,3)4/h2*1-2H,(H2,6,7,8,9,10);;(H2,1,2,3,4)/q;;+2;/p-2