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9-(4-methylphenyl)sulfonyl-3H-purine-6-thione

9-(4-methylphenyl)sulfonyl-3H-purine-6-thione

Systemtic Name:9-(4-methylphenyl)sulfonyl-3H-purine-6-thione
Openeye Name:9-(p-tolylsulfonyl)-3H-purine-6-thione
CAS Name:9-(4-methylphenyl)sulfonyl-3H-purine-6-thione
IUPAC Name:9-(4-methylphenyl)sulfonyl-3H-purine-6-thione
Traditional Name:9-tosyl-3H-purine-6-thione
Formula: C12H10N4O2S2
MolecularWeight: 306.3634
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=NC3=C2NC=NC3=S


Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=NC3=C2NC=NC3=S


InChI

InChI=1S/C12H10N4O2S2/c1-8-2-4-9(5-3-8)20(17,18)16-7-15-10-11(16)13-6-14-12(10)19/h2-7H,1H3,(H,13,14,19)


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