4-[(3S)-2-oxidanylideneoxolan-3-yl]-5-phenyl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-[(3S)-2-oxidanylideneoxolan-3-yl]-5-phenyl-1,2,4-triazole-3-thiolate Openeye Name: 4-[(3S)-2-oxotetrahydrofuran-3-yl]-5-phenyl-1,2,4-triazole-3-thiolate CAS Name: 4-[(3S)-2-oxo-3-oxolanyl]-5-phenyl-1,2,4-triazole-3-thiolate IUPAC Name: 4-[(3S)-2-oxooxolan-3-yl]-5-phenyl-1,2,4-triazole-3-thiolate Traditional Name: 4-[(3S)-2-ketotetrahydrofuran-3-yl]-5-phenyl-1,2,4-triazole-3-thiolate Formula: C12H10N3O2S- MolecularWeight: 260.2917

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(=O)C1N2C(=NN=C2[S-])C3=CC=CC=C3

Isomeric SMILES

C1COC(=O)[C@H]1N2C(=NN=C2[S-])C3=CC=CC=C3

InChI

InChI=1S/C12H11N3O2S/c16-11-9(6-7-17-11)15-10(13-14-12(15)18)8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,14,18)/p-1/t9-/m0/s1