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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=O)N(C(=O)N2C)C)NC1=S

Isomeric SMILES

CCN1C2=C(C(=O)N(C(=O)N2C)C)NC1=S

InChI

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