1,3-dimethyl-7-(oxiran-2-ylmethyl)-8-sulfanylidene-9H-purine-2,6-dione

Systemtic Name: 1,3-dimethyl-7-(oxiran-2-ylmethyl)-8-sulfanylidene-9H-purine-2,6-dione Openeye Name: 1,3-dimethyl-7-(oxiran-2-ylmethyl)-8-thioxo-9H-purine-2,6-dione CAS Name: 1,3-dimethyl-7-(2-oxiranylmethyl)-8-sulfanylidene-9H-purine-2,6-dione IUPAC Name: 1,3-dimethyl-7-(oxiran-2-ylmethyl)-8-sulfanylidene-9H-purine-2,6-dione Traditional Name: 7-glycidyl-1,3-dimethyl-8-thioxo-9H-purine-2,6-quinone Formula: C10H12N4O3S MolecularWeight: 268.29228

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=S)N2)CC3CO3

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=S)N2)CC3CO3

InChI

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