7-ethyl-1,3-dimethyl-8-sulfanylidene-9H-purine-2,6-dione

Systemtic Name: 7-ethyl-1,3-dimethyl-8-sulfanylidene-9H-purine-2,6-dione Openeye Name: 7-ethyl-1,3-dimethyl-8-thioxo-9H-purine-2,6-dione CAS Name: 7-ethyl-1,3-dimethyl-8-sulfanylidene-9H-purine-2,6-dione IUPAC Name: 7-ethyl-1,3-dimethyl-8-sulfanylidene-9H-purine-2,6-dione Traditional Name: 7-ethyl-1,3-dimethyl-8-thioxo-9H-purine-2,6-quinone Formula: C9H12N4O2S MolecularWeight: 240.28218

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(NC1=S)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CCN1C2=C(NC1=S)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C9H12N4O2S/c1-4-13-5-6(10-8(13)16)11(2)9(15)12(3)7(5)14/h4H2,1-3H3,(H,10,16)