2-[[4-[(3S)-2-oxidanylideneoxolan-3-yl]-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanoate

Systemtic Name: 2-[[4-[(3S)-2-oxidanylideneoxolan-3-yl]-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: 2-[[4-[(3S)-2-oxotetrahydrofuran-3-yl]-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[4-[(3S)-2-oxo-3-oxolanyl]-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]acetate IUPAC Name: 2-[[4-[(3S)-2-oxooxolan-3-yl]-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[4-[(3S)-2-ketotetrahydrofuran-3-yl]-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetate Formula: C12H10N3O4S2- MolecularWeight: 324.3555

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(=O)C1N2C(=NN=C2SCC(=O)[O-])C3=CC=CS3

Isomeric SMILES

C1COC(=O)[C@H]1N2C(=NN=C2SCC(=O)[O-])C3=CC=CS3

InChI

InChI=1S/C12H11N3O4S2/c16-9(17)6-21-12-14-13-10(8-2-1-5-20-8)15(12)7-3-4-19-11(7)18/h1-2,5,7H,3-4,6H2,(H,16,17)/p-1/t7-/m0/s1