7-(1,3-dithiolan-2-ylmethyl)-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-(1,3-dithiolan-2-ylmethyl)-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-(1,3-dithiolan-2-ylmethyl)-1,3-dimethyl-purine-2,6-dione CAS Name: 7-(1,3-dithiolan-2-ylmethyl)-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-(1,3-dithiolan-2-ylmethyl)-1,3-dimethylpurine-2,6-dione Traditional Name: 7-(1,3-dithiolan-2-ylmethyl)-1,3-dimethyl-xanthine Formula: C11H14N4O2S2 MolecularWeight: 298.38446

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC3SCCS3

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC3SCCS3

InChI

InChI=1S/C11H14N4O2S2/c1-13-9-8(10(16)14(2)11(13)17)15(6-12-9)5-7-18-3-4-19-7/h6-7H,3-5H2,1-2H3