WAH
Summary
| Name: | N-ethyl-1-(4-fluorophenyl)methanesulfonamide |
| Formula: | C9 H12 F N O2 S |
| Formal charge: | 0 |
| Formula weight: | 217.26 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-ethyl-1-(4-fluorophenyl)methanesulfonamide |
| OpenEye OEToolkits | 2.0.7 | ~{N}-ethyl-1-(4-fluorophenyl)methanesulfonamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Fc1ccc(CS(=O)(=O)NCC)cc1 |
| InChI | InChI | 1.06 | InChI=1S/C9H12FNO2S/c1-2-11-14(12,13)7-8-3-5-9(10)6-4-8/h3-6,11H,2,7H2,1H3 |
| InChIKey | InChI | 1.06 | XYQKYGZWSZZGOM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCN[S](=O)(=O)Cc1ccc(F)cc1 |
| SMILES | CACTVS | 3.385 | CCN[S](=O)(=O)Cc1ccc(F)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCNS(=O)(=O)Cc1ccc(cc1)F |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCNS(=O)(=O)Cc1ccc(cc1)F |
