I9R
Summary
| Name: | 5,8-dimethoxy-[1,2,4]triazolo[3,4-b][1,3]benzothiazole |
| Formula: | C10 H9 N3 O2 S |
| Formal charge: | 0 |
| Formula weight: | 235.262 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 5,8-dimethoxy-[1,2,4]triazolo[3,4-b][1,3]benzothiazole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C10H9N3O2S/c1-14-6-3-4-7(15-2)9-8(6)13-5-11-12-10(13)16-9/h3-5H,1-2H3 |
| InChIKey | InChI | 1.06 | VIBQQSCMGFVXHL-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(OC)c2n3cnnc3sc12 |
| SMILES | CACTVS | 3.385 | COc1ccc(OC)c2n3cnnc3sc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1ccc(c2c1n3cnnc3s2)OC |
| SMILES | OpenEye OEToolkits | 2.0.7 | COc1ccc(c2c1n3cnnc3s2)OC |
