2-(4-oxidanylidene-2-sulfanylidene-1H-pteridin-3-yl)ethanoic acid

Systemtic Name: 2-(4-oxidanylidene-2-sulfanylidene-1H-pteridin-3-yl)ethanoic acid Openeye Name: 2-(4-oxo-2-thioxo-1H-pteridin-3-yl)acetic acid CAS Name: 2-(4-oxo-2-sulfanylidene-1H-pteridin-3-yl)acetic acid IUPAC Name: 2-(4-oxo-2-sulfanylidene-1H-pteridin-3-yl)acetic acid Traditional Name: 2-(4-keto-2-thioxo-1H-pteridin-3-yl)acetic acid Formula: C8H6N4O3S MolecularWeight: 238.22324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C2C(=N1)C(=O)N(C(=S)N2)CC(=O)O

Isomeric SMILES

C1=CN=C2C(=N1)C(=O)N(C(=S)N2)CC(=O)O

InChI

InChI=1S/C8H6N4O3S/c13-4(14)3-12-7(15)5-6(11-8(12)16)10-2-1-9-5/h1-2H,3H2,(H,13,14)(H,10,11,16)