3,7-dimethyl-8-sulfanylidene-9H-purine-2,6-dione

Systemtic Name: 3,7-dimethyl-8-sulfanylidene-9H-purine-2,6-dione Openeye Name: 3,7-dimethyl-8-thioxo-9H-purine-2,6-dione CAS Name: 3,7-dimethyl-8-sulfanylidene-9H-purine-2,6-dione IUPAC Name: 3,7-dimethyl-8-sulfanylidene-9H-purine-2,6-dione Traditional Name: 3,7-dimethyl-8-thioxo-9H-purine-2,6-quinone Formula: C7H8N4O2S MolecularWeight: 212.22902

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(NC1=S)N(C(=O)NC2=O)C

Isomeric SMILES

CN1C2=C(NC1=S)N(C(=O)NC2=O)C

InChI

InChI=1S/C7H8N4O2S/c1-10-3-4(8-7(10)14)11(2)6(13)9-5(3)12/h1-2H3,(H,8,14)(H,9,12,13)