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2-(9-methylpurin-6-yl)sulfanylethanoic acid

2-(9-methylpurin-6-yl)sulfanylethanoic acid

Systemtic Name:2-(9-methylpurin-6-yl)sulfanylethanoic acid
Openeye Name:2-(9-methylpurin-6-yl)sulfanylacetic acid
CAS Name:2-[(9-methyl-6-purinyl)thio]acetic acid
IUPAC Name:2-(9-methylpurin-6-yl)sulfanylacetic acid
Traditional Name:2-[(9-methylpurin-6-yl)thio]acetic acid
Formula: C8H8N4O2S
MolecularWeight: 224.23972
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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1N=CN=C2SCC(=O)O


Isomeric SMILES

CN1C=NC2=C1N=CN=C2SCC(=O)O


InChI

InChI=1S/C8H8N4O2S/c1-12-4-11-6-7(12)9-3-10-8(6)15-2-5(13)14/h3-4H,2H2,1H3,(H,13,14)


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