2JX
5-[(2R)-2,3-dihydro-1,4-benzodioxin-2-yl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Component Summary | |
|---|---|
| Name | 5-[(2R)-2,3-dihydro-1,4-benzodioxin-2-yl]-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Identifiers | 3-[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-1,4-dihydro-1,2,4-triazole-5-thione |
| Formula | C10 H9 N3 O2 S |
| Molecular Weight | 235.262 |
| Type | NON-POLYMER |
| Isomeric SMILES | c1ccc2c(c1)OC[C@H](O2)C3=NNC(=S)N3 |
| InChI | InChI=1S/C10H9N3O2S/c16-10-11-9(12-13-10)8-5-14-6-3-1-2-4-7(6)15-8/h1-4,8H,5H2,(H2,11,12,13,16)/t8-/m0/s1 |
| InChIKey | WDUGNJIRKJHDNF-QMMMGPOBSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 25 |
| Chiral Atom Count | 1 |
| Bond Count | 27 |
| Aromatic Bond Count | 6 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 789293 |
