RJY
Summary
| Name: | ethyl 2-methyl-1,3-thiazole-4-carboxylate |
| Formula: | C7 H9 N O2 S |
| Formal charge: | 0 |
| Formula weight: | 171.217 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | ethyl 2-methyl-1,3-thiazole-4-carboxylate |
| OpenEye OEToolkits | 2.0.7 | ethyl 2-methyl-1,3-thiazole-4-carboxylate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Cc1scc(C(=O)OCC)n1 |
| InChI | InChI | 1.03 | InChI=1S/C7H9NO2S/c1-3-10-7(9)6-4-11-5(2)8-6/h4H,3H2,1-2H3 |
| InChIKey | InChI | 1.03 | QWWPUBQHZFHZSF-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCOC(=O)c1csc(C)n1 |
| SMILES | CACTVS | 3.385 | CCOC(=O)c1csc(C)n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCOC(=O)c1csc(n1)C |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCOC(=O)c1csc(n1)C |
