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

Systemtic Name: 2-[[4-[(3S)-2-oxidanylideneoxolan-3-yl]-5-propyl-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: 2-[[4-[(3S)-2-oxotetrahydrofuran-3-yl]-5-propyl-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[4-[(3S)-2-oxo-3-oxolanyl]-5-propyl-1,2,4-triazol-3-yl]thio]acetate IUPAC Name: 2-[[4-[(3S)-2-oxooxolan-3-yl]-5-propyl-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[4-[(3S)-2-ketotetrahydrofuran-3-yl]-5-propyl-1,2,4-triazol-3-yl]thio]acetate Formula: C11H14N3O4S- MolecularWeight: 284.31156

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(N1C2CCOC2=O)SCC(=O)[O-]

Isomeric SMILES

CCCC1=NN=C(N1[C@H]2CCOC2=O)SCC(=O)[O-]

InChI

InChI=1S/C11H15N3O4S/c1-2-3-8-12-13-11(19-6-9(15)16)14(8)7-4-5-18-10(7)17/h7H,2-6H2,1H3,(H,15,16)/p-1/t7-/m0/s1