UR1
Summary
| Name: | 3-fluoro-5-methylbenzene-1-sulfonamide |
| Formula: | C7 H8 F N O2 S |
| Formal charge: | 0 |
| Formula weight: | 189.207 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3-fluoro-5-methylbenzene-1-sulfonamide |
| OpenEye OEToolkits | 2.0.7 | 3-fluoranyl-5-methyl-benzenesulfonamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c1c(S(N)(=O)=O)cc(C)cc1F |
| InChI | InChI | 1.03 | InChI=1S/C7H8FNO2S/c1-5-2-6(8)4-7(3-5)12(9,10)11/h2-4H,1H3,(H2,9,10,11) |
| InChIKey | InChI | 1.03 | RMTMZIARFLDIKQ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1cc(F)cc(c1)[S](N)(=O)=O |
| SMILES | CACTVS | 3.385 | Cc1cc(F)cc(c1)[S](N)(=O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1cc(cc(c1)S(=O)(=O)N)F |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cc(cc(c1)S(=O)(=O)N)F |
