2-(1-methyl-6-sulfanylidene-purin-9-yl)ethanoic acid

Systemtic Name: 2-(1-methyl-6-sulfanylidene-purin-9-yl)ethanoic acid Openeye Name: 2-(1-methyl-6-thioxo-purin-9-yl)acetic acid CAS Name: 2-(1-methyl-6-sulfanylidene-9-purinyl)acetic acid IUPAC Name: 2-(1-methyl-6-sulfanylidenepurin-9-yl)acetic acid Traditional Name: 2-(1-methyl-6-thioxo-purin-9-yl)acetic acid Formula: C8H8N4O2S MolecularWeight: 224.23972

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C(C1=S)N=CN2CC(=O)O

Isomeric SMILES

CN1C=NC2=C(C1=S)N=CN2CC(=O)O

InChI

InChI=1S/C8H8N4O2S/c1-11-3-10-7-6(8(11)15)9-4-12(7)2-5(13)14/h3-4H,2H2,1H3,(H,13,14)