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9-(phenylmethyl)-3H-purine-6-thione

9-(phenylmethyl)-3H-purine-6-thione

Systemtic Name:9-(phenylmethyl)-3H-purine-6-thione
Openeye Name:9-benzyl-3H-purine-6-thione
CAS Name:9-(phenylmethyl)-3H-purine-6-thione
IUPAC Name:9-benzyl-3H-purine-6-thione
Traditional Name:9-benzyl-3H-purine-6-thione
Formula: C12H10N4S
MolecularWeight: 242.2996
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC3=C2NC=NC3=S


Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC3=C2NC=NC3=S


InChI

InChI=1S/C12H10N4S/c17-12-10-11(13-7-14-12)16(8-15-10)6-9-4-2-1-3-5-9/h1-5,7-8H,6H2,(H,13,14,17)


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