A1EE3
Summary
| Name: | 4-prop-2-ynyl-1,4-thiazinane 1,1-dioxide |
| Synonyms: | 4-Propargylthiomorpholine 1,1-Dioxide |
| Formula: | C7 H11 N O2 S |
| Formal charge: | 0 |
| Formula weight: | 173.233 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 4-prop-2-ynyl-1,4-thiazinane 1,1-dioxide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C7H11NO2S/c1-2-3-8-4-6-11(9,10)7-5-8/h1H,3-7H2 |
| InChIKey | InChI | 1.06 | CZBZIZOYSYHBNM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=[S]1(=O)CCN(CC1)CC#C |
| SMILES | CACTVS | 3.385 | O=[S]1(=O)CCN(CC1)CC#C |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C#CCN1CCS(=O)(=O)CC1 |
| SMILES | OpenEye OEToolkits | 2.0.7 | C#CCN1CCS(=O)(=O)CC1 |
