2-[(6-methylsulfanyl-7H-purin-2-yl)amino]ethanoic acid

Systemtic Name: 2-[(6-methylsulfanyl-7H-purin-2-yl)amino]ethanoic acid Openeye Name: 2-[(6-methylsulfanyl-7H-purin-2-yl)amino]acetic acid CAS Name: 2-[[6-(methylthio)-7H-purin-2-yl]amino]acetic acid IUPAC Name: 2-[(6-methylsulfanyl-7H-purin-2-yl)amino]acetic acid Traditional Name: 2-[[6-(methylthio)-7H-purin-2-yl]amino]acetic acid Formula: C8H9N5O2S MolecularWeight: 239.25436

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NC2=C1NC=N2)NCC(=O)O

Isomeric SMILES

CSC1=NC(=NC2=C1NC=N2)NCC(=O)O

InChI

InChI=1S/C8H9N5O2S/c1-16-7-5-6(11-3-10-5)12-8(13-7)9-2-4(14)15/h3H,2H2,1H3,(H,14,15)(H2,9,10,11,12,13)