4-(2,5-dimethoxyphenyl)-5-[(2R)-oxolan-2-yl]-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(2,5-dimethoxyphenyl)-5-[(2R)-oxolan-2-yl]-1,2,4-triazole-3-thiolate Openeye Name: 4-(2,5-dimethoxyphenyl)-5-[(2R)-tetrahydrofuran-2-yl]-1,2,4-triazole-3-thiolate CAS Name: 4-(2,5-dimethoxyphenyl)-5-[(2R)-2-oxolanyl]-1,2,4-triazole-3-thiolate IUPAC Name: 4-(2,5-dimethoxyphenyl)-5-[(2R)-oxolan-2-yl]-1,2,4-triazole-3-thiolate Traditional Name: 4-(2,5-dimethoxyphenyl)-5-[(2R)-tetrahydrofuran-2-yl]-1,2,4-triazole-3-thiolate Formula: C14H16N3O3S- MolecularWeight: 306.36014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)N2C(=NN=C2[S-])C3CCCO3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)N2C(=NN=C2[S-])[C@H]3CCCO3

InChI

InChI=1S/C14H17N3O3S/c1-18-9-5-6-11(19-2)10(8-9)17-13(15-16-14(17)21)12-4-3-7-20-12/h5-6,8,12H,3-4,7H2,1-2H3,(H,16,21)/p-1/t12-/m1/s1