2-[[4-(2-oxidanylideneoxolan-3-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[4-(2-oxidanylideneoxolan-3-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[4-(2-oxotetrahydrofuran-3-yl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid CAS Name: 2-[[4-(2-oxo-3-oxolanyl)-1,2,4-triazol-3-yl]thio]acetic acid IUPAC Name: 2-[[4-(2-oxooxolan-3-yl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid Traditional Name: 2-[[4-(2-ketotetrahydrofuran-3-yl)-1,2,4-triazol-3-yl]thio]acetic acid Formula: C8H9N3O4S MolecularWeight: 243.23976

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(=O)C1N2C=NN=C2SCC(=O)O

Isomeric SMILES

C1COC(=O)C1N2C=NN=C2SCC(=O)O

InChI

InChI=1S/C8H9N3O4S/c12-6(13)3-16-8-10-9-4-11(8)5-1-2-15-7(5)14/h4-5H,1-3H2,(H,12,13)