1,3-dimethyl-8-(methylsulfanylmethyl)-7H-purine-2,6-dione

Systemtic Name: 1,3-dimethyl-8-(methylsulfanylmethyl)-7H-purine-2,6-dione Openeye Name: 1,3-dimethyl-8-(methylsulfanylmethyl)-7H-purine-2,6-dione CAS Name: 1,3-dimethyl-8-[(methylthio)methyl]-7H-purine-2,6-dione IUPAC Name: 1,3-dimethyl-8-(methylsulfanylmethyl)-7H-purine-2,6-dione Traditional Name: 1,3-dimethyl-8-[(methylthio)methyl]-7H-purine-2,6-quinone Formula: C9H12N4O2S MolecularWeight: 240.28218

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)CSC

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)CSC

InChI

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