2-azanyl-3-(7H-purin-6-ylsulfanyl)propanoic acid

Systemtic Name: 2-azanyl-3-(7H-purin-6-ylsulfanyl)propanoic acid Openeye Name: 2-amino-3-(7H-purin-6-ylsulfanyl)propanoic acid CAS Name: 2-amino-3-(7H-purin-6-ylthio)propanoic acid IUPAC Name: 2-amino-3-(7H-purin-6-ylsulfanyl)propanoic acid Traditional Name: 2-amino-3-(7H-purin-6-ylthio)propionic acid Formula: C8H9N5O2S MolecularWeight: 239.25436

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1)C(=NC=N2)SCC(C(=O)O)N

Isomeric SMILES

C1=NC2=C(N1)C(=NC=N2)SCC(C(=O)O)N

InChI

InChI=1S/C8H9N5O2S/c9-4(8(14)15)1-16-7-5-6(11-2-10-5)12-3-13-7/h2-4H,1,9H2,(H,14,15)(H,10,11,12,13)