3-(4-oxidanylidene-2-sulfanylidene-1H-pyrido[3,2-d]pyrimidin-3-yl)propanoic acid

Systemtic Name: 3-(4-oxidanylidene-2-sulfanylidene-1H-pyrido[3,2-d]pyrimidin-3-yl)propanoic acid Openeye Name: 3-(4-oxo-2-thioxo-1H-pyrido[3,2-d]pyrimidin-3-yl)propanoic acid CAS Name: 3-(4-oxo-2-sulfanylidene-1H-pyrido[3,2-d]pyrimidin-3-yl)propanoic acid IUPAC Name: 3-(4-oxo-2-sulfanylidene-1H-pyrido[3,2-d]pyrimidin-3-yl)propanoic acid Traditional Name: 3-(4-keto-2-thioxo-1H-pyrido[3,2-d]pyrimidin-3-yl)propionic acid Formula: C10H9N3O3S MolecularWeight: 251.26176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=O)N(C(=S)N2)CCC(=O)O)N=C1

Isomeric SMILES

C1=CC2=C(C(=O)N(C(=S)N2)CCC(=O)O)N=C1

InChI

InChI=1S/C10H9N3O3S/c14-7(15)3-5-13-9(16)8-6(12-10(13)17)2-1-4-11-8/h1-2,4H,3,5H2,(H,12,17)(H,14,15)