ethyl 1,3-dimethyl-2-oxidanylidene-6-sulfanylidene-purine-7-carboxylate

Systemtic Name: ethyl 1,3-dimethyl-2-oxidanylidene-6-sulfanylidene-purine-7-carboxylate Openeye Name: ethyl 1,3-dimethyl-2-oxo-6-thioxo-purine-7-carboxylate CAS Name: 1,3-dimethyl-2-oxo-6-sulfanylidene-7-purinecarboxylic acid ethyl ester IUPAC Name: ethyl 1,3-dimethyl-2-oxo-6-sulfanylidenepurine-7-carboxylate Traditional Name: 2-keto-1,3-dimethyl-6-thioxo-purine-7-carboxylic acid ethyl ester Formula: C10H12N4O3S MolecularWeight: 268.29228

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C=NC2=C1C(=S)N(C(=O)N2C)C

Isomeric SMILES

CCOC(=O)N1C=NC2=C1C(=S)N(C(=O)N2C)C

InChI

InChI=1S/C10H12N4O3S/c1-4-17-10(16)14-5-11-7-6(14)8(18)13(3)9(15)12(7)2/h5H,4H2,1-3H3