A1COM
Summary
| Name: | (3M)-3-(2-methyl-1,3-thiazol-4-yl)pyridine |
| Formula: | C9 H8 N2 S |
| Formal charge: | 0 |
| Formula weight: | 176.238 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | (3M)-3-(2-methyl-1,3-thiazol-4-yl)pyridine |
| OpenEye OEToolkits | 3.1.0.0 | 2-methyl-4-pyridin-3-yl-1,3-thiazole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | Cc1nc(cs1)c1cnccc1 |
| InChI | InChI | 1.06 | InChI=1S/C9H8N2S/c1-7-11-9(6-12-7)8-3-2-4-10-5-8/h2-6H,1H3 |
| InChIKey | InChI | 1.06 | PVUGYBMZXNBOPD-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1scc(n1)c2cccnc2 |
| SMILES | CACTVS | 3.385 | Cc1scc(n1)c2cccnc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | Cc1nc(cs1)c2cccnc2 |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | Cc1nc(cs1)c2cccnc2 |
