A1L8D
Summary
| Name: | ~{N}-[4-(trifluoromethyl)phenyl]sulfonylpyridine-2-carboxamide |
| Formula: | C13 H9 F3 N2 O3 S |
| Formal charge: | 0 |
| Formula weight: | 330.282 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N}-[4-(trifluoromethyl)phenyl]sulfonylpyridine-2-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C13H9F3N2O3S/c14-13(15,16)9-4-6-10(7-5-9)22(20,21)18-12(19)11-3-1-2-8-17-11/h1-8H,(H,18,19) |
| InChIKey | InChI | 1.06 | CPWLQDMYBULSTL-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | FC(F)(F)c1ccc(cc1)[S](=O)(=O)NC(=O)c2ccccn2 |
| SMILES | CACTVS | 3.385 | FC(F)(F)c1ccc(cc1)[S](=O)(=O)NC(=O)c2ccccn2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccnc(c1)C(=O)NS(=O)(=O)c2ccc(cc2)C(F)(F)F |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccnc(c1)C(=O)NS(=O)(=O)c2ccc(cc2)C(F)(F)F |
