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2-[(6-azanyl-7H-purin-8-yl)sulfanyl]propanoic acid

2-[(6-azanyl-7H-purin-8-yl)sulfanyl]propanoic acid

Systemtic Name:2-[(6-azanyl-7H-purin-8-yl)sulfanyl]propanoic acid
Openeye Name:2-[(6-amino-7H-purin-8-yl)sulfanyl]propanoic acid
CAS Name:2-[(6-amino-7H-purin-8-yl)thio]propanoic acid
IUPAC Name:2-[(6-amino-7H-purin-8-yl)sulfanyl]propanoic acid
Traditional Name:2-[(6-amino-7H-purin-8-yl)thio]propionic acid
Formula: C8H9N5O2S
MolecularWeight: 239.25436
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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1=NC2=C(N1)C(=NC=N2)N


Isomeric SMILES

CC(C(=O)O)SC1=NC2=C(N1)C(=NC=N2)N


InChI

InChI=1S/C8H9N5O2S/c1-3(7(14)15)16-8-12-4-5(9)10-2-11-6(4)13-8/h2-3H,1H3,(H,14,15)(H3,9,10,11,12,13)


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