2-[(2-azanyl-5H-purin-6-yl)sulfanyl]ethanoic acid

Systemtic Name: 2-[(2-azanyl-5H-purin-6-yl)sulfanyl]ethanoic acid Openeye Name: 2-[(2-amino-5H-purin-6-yl)sulfanyl]acetic acid CAS Name: 2-[(2-amino-5H-purin-6-yl)thio]acetic acid IUPAC Name: 2-[(2-amino-5H-purin-6-yl)sulfanyl]acetic acid Traditional Name: 2-[(2-amino-5H-purin-6-yl)thio]acetic acid Formula: C7H7N5O2S MolecularWeight: 225.22778

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2C(=N1)N=C(N=C2SCC(=O)O)N

Isomeric SMILES

C1=NC2C(=N1)N=C(N=C2SCC(=O)O)N

InChI

InChI=1S/C7H7N5O2S/c8-7-11-5-4(9-2-10-5)6(12-7)15-1-3(13)14/h2,4H,1H2,(H,13,14)(H2,8,9,10,11)