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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(NC(=S)N2C)N(C1=O)C

Isomeric SMILES

CCN1C(=O)C2=C(NC(=S)N2C)N(C1=O)C

InChI

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