I1B
Summary
| Name: | 6,8-dimethyl-[1,2,4]triazolo[3,4-b][1,3]benzothiazole |
| Synonyms: | 5,7-Dimethyl(1,2,4)triazolo(3,4-b)(1,3)benzothiazole |
| Formula: | C10 H9 N3 S |
| Formal charge: | 0 |
| Formula weight: | 203.264 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 6,8-dimethyl-[1,2,4]triazolo[3,4-b][1,3]benzothiazole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C10H9N3S/c1-6-3-7(2)9-8(4-6)14-10-12-11-5-13(9)10/h3-5H,1-2H3 |
| InChIKey | InChI | 1.06 | OSXXJJFPJYFCPT-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1cc(C)c2n3cnnc3sc2c1 |
| SMILES | CACTVS | 3.385 | Cc1cc(C)c2n3cnnc3sc2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1cc(c2c(c1)sc3n2cnn3)C |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cc(c2c(c1)sc3n2cnn3)C |
