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

Systemtic Name: 8-propylsulfanyl-3,7-dihydropurine-2,6-dione Openeye Name: 8-propylsulfanyl-3,7-dihydropurine-2,6-dione CAS Name: 8-(propylthio)-3,7-dihydropurine-2,6-dione IUPAC Name: 8-propylsulfanyl-3,7-dihydropurine-2,6-dione Traditional Name: 8-(propylthio)-7H-xanthine Formula: C8H10N4O2S MolecularWeight: 226.2556

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC2=C(N1)C(=O)NC(=O)N2

Isomeric SMILES

CCCSC1=NC2=C(N1)C(=O)NC(=O)N2

InChI

InChI=1S/C8H10N4O2S/c1-2-3-15-8-9-4-5(11-8)10-7(14)12-6(4)13/h2-3H2,1H3,(H3,9,10,11,12,13,14)