WHM
Summary
| Name: | 2-[(3-fluorophenyl)methyl]-1lambda~6~,2-thiazolidine-1,1-dione |
| Formula: | C10 H12 F N O2 S |
| Formal charge: | 0 |
| Formula weight: | 229.271 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-[(3-fluorophenyl)methyl]-1lambda~6~,2-thiazolidine-1,1-dione |
| OpenEye OEToolkits | 2.0.7 | 2-[(3-fluorophenyl)methyl]-1,2-thiazolidine 1,1-dioxide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c2(CN1CCCS1(=O)=O)cccc(c2)F |
| InChI | InChI | 1.03 | InChI=1S/C10H12FNO2S/c11-10-4-1-3-9(7-10)8-12-5-2-6-15(12,13)14/h1,3-4,7H,2,5-6,8H2 |
| InChIKey | InChI | 1.03 | RVDJKNWVTKGWCE-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Fc1cccc(CN2CCC[S]2(=O)=O)c1 |
| SMILES | CACTVS | 3.385 | Fc1cccc(CN2CCC[S]2(=O)=O)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(cc(c1)F)CN2CCCS2(=O)=O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(cc(c1)F)CN2CCCS2(=O)=O |
