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3,7-dihydropurine-6-thione hydrate

3,7-dihydropurine-6-thione hydrate

Systemtic Name:3,7-dihydropurine-6-thione hydrate
Openeye Name:3,7-dihydropurine-6-thione hydrate
CAS Name:3,7-dihydropurine-6-thione hydrate
IUPAC Name:3,7-dihydropurine-6-thione hydrate
Traditional Name:3,7-dihydropurine-6-thione hydrate
Formula: C5H6N4OS
MolecularWeight: 170.19234
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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1)C(=S)N=CN2.O


Isomeric SMILES

C1=NC2=C(N1)C(=S)N=CN2.O


InChI

InChI=1S/C5H4N4S.H2O/c10-5-3-4(7-1-6-3)8-2-9-5;/h1-2H,(H2,6,7,8,9,10);1H2


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