2-(3-oxidanylpurin-6-yl)sulfanylethanoic acid

Systemtic Name: 2-(3-oxidanylpurin-6-yl)sulfanylethanoic acid Openeye Name: 2-(3-hydroxypurin-6-yl)sulfanylacetic acid CAS Name: 2-[(3-hydroxy-6-purinyl)thio]acetic acid IUPAC Name: 2-(3-hydroxypurin-6-yl)sulfanylacetic acid Traditional Name: 2-[(3-hydroxypurin-6-yl)thio]acetic acid Formula: C7H6N4O3S MolecularWeight: 226.21254

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N=CN(C2=N1)O)SCC(=O)O

Isomeric SMILES

C1=NC2=C(N=CN(C2=N1)O)SCC(=O)O

InChI

InChI=1S/C7H6N4O3S/c12-4(13)1-15-7-5-6(9-2-8-5)11(14)3-10-7/h2-3,14H,1H2,(H,12,13)