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2-hexylsulfanyl-7,9-dihydro-3H-purine-6,8-dione

2-hexylsulfanyl-7,9-dihydro-3H-purine-6,8-dione

Systemtic Name:2-hexylsulfanyl-7,9-dihydro-3H-purine-6,8-dione
Openeye Name:2-hexylsulfanyl-7,9-dihydro-3H-purine-6,8-dione
CAS Name:2-(hexylthio)-7,9-dihydro-3H-purine-6,8-dione
IUPAC Name:2-hexylsulfanyl-7,9-dihydro-3H-purine-6,8-dione
Traditional Name:2-(hexylthio)-7,9-dihydro-3H-purine-6,8-quinone
Formula: C11H16N4O2S
MolecularWeight: 268.33534
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=NC(=O)C2=C(N1)NC(=O)N2


Isomeric SMILES

CCCCCCSC1=NC(=O)C2=C(N1)NC(=O)N2


InChI

InChI=1S/C11H16N4O2S/c1-2-3-4-5-6-18-11-14-8-7(9(16)15-11)12-10(17)13-8/h2-6H2,1H3,(H3,12,13,14,15,16,17)


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