8-ethylsulfanyl-3,7-dihydropurine-2,6-dione

Systemtic Name: 8-ethylsulfanyl-3,7-dihydropurine-2,6-dione Openeye Name: 8-ethylsulfanyl-3,7-dihydropurine-2,6-dione CAS Name: 8-(ethylthio)-3,7-dihydropurine-2,6-dione IUPAC Name: 8-ethylsulfanyl-3,7-dihydropurine-2,6-dione Traditional Name: 8-(ethylthio)-7H-xanthine Formula: C7H8N4O2S MolecularWeight: 212.22902

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=C(N1)C(=O)NC(=O)N2

Isomeric SMILES

CCSC1=NC2=C(N1)C(=O)NC(=O)N2

InChI

InChI=1S/C7H8N4O2S/c1-2-14-7-8-3-4(10-7)9-6(13)11-5(3)12/h2H2,1H3,(H3,8,9,10,11,12,13)