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

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-5-[(2R)-oxolan-2-yl]-1,2,4-triazole-3-thiolate Openeye Name: 4-(1,3-benzodioxol-5-yl)-5-[(2R)-tetrahydrofuran-2-yl]-1,2,4-triazole-3-thiolate CAS Name: 4-(1,3-benzodioxol-5-yl)-5-[(2R)-2-oxolanyl]-1,2,4-triazole-3-thiolate IUPAC Name: 4-(1,3-benzodioxol-5-yl)-5-[(2R)-oxolan-2-yl]-1,2,4-triazole-3-thiolate Traditional Name: 4-(1,3-benzodioxol-5-yl)-5-[(2R)-tetrahydrofuran-2-yl]-1,2,4-triazole-3-thiolate Formula: C13H12N3O3S- MolecularWeight: 290.31768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)C2=NN=C(N2C3=CC4=C(C=C3)OCO4)[S-]

Isomeric SMILES

C1C[C@@H](OC1)C2=NN=C(N2C3=CC4=C(C=C3)OCO4)[S-]

InChI

InChI=1S/C13H13N3O3S/c20-13-15-14-12(10-2-1-5-17-10)16(13)8-3-4-9-11(6-8)19-7-18-9/h3-4,6,10H,1-2,5,7H2,(H,15,20)/p-1/t10-/m1/s1