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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=NC2C(=NC(=NC2=N1)SCC(=O)O)N

Isomeric SMILES

C1=NC2C(=NC(=NC2=N1)SCC(=O)O)N

InChI

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