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1,3,7-trimethyl-8-(1-methylimidazol-2-yl)sulfanyl-purine-2,6-dione

1,3,7-trimethyl-8-(1-methylimidazol-2-yl)sulfanyl-purine-2,6-dione

Systemtic Name:1,3,7-trimethyl-8-(1-methylimidazol-2-yl)sulfanyl-purine-2,6-dione
Openeye Name:1,3,7-trimethyl-8-(1-methylimidazol-2-yl)sulfanyl-purine-2,6-dione
CAS Name:1,3,7-trimethyl-8-[(1-methyl-2-imidazolyl)thio]purine-2,6-dione
IUPAC Name:1,3,7-trimethyl-8-(1-methylimidazol-2-yl)sulfanylpurine-2,6-dione
Traditional Name:1,3,7-trimethyl-8-[(1-methylimidazol-2-yl)thio]xanthine
Formula: C12H14N6O2S
MolecularWeight: 306.34356
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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SC2=NC3=C(N2C)C(=O)N(C(=O)N3C)C


Isomeric SMILES

CN1C=CN=C1SC2=NC3=C(N2C)C(=O)N(C(=O)N3C)C


InChI

InChI=1S/C12H14N6O2S/c1-15-6-5-13-10(15)21-11-14-8-7(16(11)2)9(19)18(4)12(20)17(8)3/h5-6H,1-4H3


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