7H-purine-2,6-diamine; sulfuric acid; hydrate

Systemtic Name: 7H-purine-2,6-diamine; sulfuric acid; hydrate Openeye Name: 7H-purine-2,6-diamine; sulfuric acid; hydrate CAS Name: 7H-purine-2,6-diamine; sulfuric acid; hydrate IUPAC Name: 7H-purine-2,6-diamine; sulfuric acid; hydrate Traditional Name: (2-amino-7H-purin-6-yl)amine; sulfuric acid; hydrate Formula: C10H16N12O5S MolecularWeight: 416.37644

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1)C(=NC(=N2)N)N.C1=NC2=C(N1)C(=NC(=N2)N)N.O.OS(=O)(=O)O

Isomeric SMILES

C1=NC2=C(N1)C(=NC(=N2)N)N.C1=NC2=C(N1)C(=NC(=N2)N)N.O.OS(=O)(=O)O

InChI

InChI=1S/2C5H6N6.H2O4S.H2O/c2*6-3-2-4(9-1-8-2)11-5(7)10-3;1-5(2,3)4;/h2*1H,(H5,6,7,8,9,10,11);(H2,1,2,3,4);1H2