XGS
Summary
| Name: | 1lambda~6~,2-thiazetidine-1,1-dione |
| Formula: | C2 H5 N O2 S |
| Formal charge: | 0 |
| Formula weight: | 107.132 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1lambda~6~,2-thiazetidine-1,1-dione |
| OpenEye OEToolkits | 2.0.7 | 1,2-thiazetidine 1,1-dioxide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=S1(NCC1)=O |
| InChI | InChI | 1.03 | InChI=1S/C2H5NO2S/c4-6(5)2-1-3-6/h3H,1-2H2 |
| InChIKey | InChI | 1.03 | GNPXXOFTVXIOLF-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=[S]1(=O)CCN1 |
| SMILES | CACTVS | 3.385 | O=[S]1(=O)CCN1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C1CS(=O)(=O)N1 |
| SMILES | OpenEye OEToolkits | 2.0.7 | C1CS(=O)(=O)N1 |
