QTG
Summary
| Name: | 4-fluoro-2-methyl-N-propylbenzene-1-sulfonamide |
| Formula: | C10 H14 F N O2 S |
| Formal charge: | 0 |
| Formula weight: | 231.287 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-fluoro-2-methyl-N-propylbenzene-1-sulfonamide |
| OpenEye OEToolkits | 2.0.7 | 4-fluoranyl-2-methyl-~{N}-propyl-benzenesulfonamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c1c(c(cc(c1)F)C)S(NCCC)(=O)=O |
| InChI | InChI | 1.03 | InChI=1S/C10H14FNO2S/c1-3-6-12-15(13,14)10-5-4-9(11)7-8(10)2/h4-5,7,12H,3,6H2,1-2H3 |
| InChIKey | InChI | 1.03 | LGSOITBLNVRJPM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCN[S](=O)(=O)c1ccc(F)cc1C |
| SMILES | CACTVS | 3.385 | CCCN[S](=O)(=O)c1ccc(F)cc1C |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCNS(=O)(=O)c1ccc(cc1C)F |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCCNS(=O)(=O)c1ccc(cc1C)F |
