ethanol; 1,3,7-trimethyl-8-sulfanylidene-9H-purine-2,6-dione; hydrochloride

Systemtic Name: ethanol; 1,3,7-trimethyl-8-sulfanylidene-9H-purine-2,6-dione; hydrochloride Openeye Name: ethanol; 1,3,7-trimethyl-8-thioxo-9H-purine-2,6-dione; hydrochloride CAS Name: ethanol; 1,3,7-trimethyl-8-sulfanylidene-9H-purine-2,6-dione; hydrochloride IUPAC Name: ethanol; 1,3,7-trimethyl-8-sulfanylidene-9H-purine-2,6-dione; hydrochloride Traditional Name: ethanol; 1,3,7-trimethyl-8-thioxo-9H-purine-2,6-quinone; hydrochloride Formula: C10H17ClN4O3S MolecularWeight: 308.78498

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Descriptors Computed from Structure

Canonical SMILES:

CCO.CN1C2=C(NC1=S)N(C(=O)N(C2=O)C)C.Cl

Isomeric SMILES

CCO.CN1C2=C(NC1=S)N(C(=O)N(C2=O)C)C.Cl

InChI

InChI=1S/C8H10N4O2S.C2H6O.ClH/c1-10-4-5(9-7(10)15)11(2)8(14)12(3)6(4)13;1-2-3;/h1-3H3,(H,9,15);3H,2H2,1H3;1H