A1CI8
Summary
| Name: | (6R)-6-phenyl-1,3-thiazinane-2,4-dione |
| Formula: | C10 H9 N O2 S |
| Formal charge: | 0 |
| Formula weight: | 207.249 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | (6R)-6-phenyl-1,3-thiazinane-2,4-dione |
| OpenEye OEToolkits | 3.1.0.0 | (6~{R})-6-phenyl-1,3-thiazinane-2,4-dione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C1NC(=O)CC(S1)c1ccccc1 |
| InChI | InChI | 1.06 | InChI=1S/C10H9NO2S/c12-9-6-8(14-10(13)11-9)7-4-2-1-3-5-7/h1-5,8H,6H2,(H,11,12,13)/t8-/m1/s1 |
| InChIKey | InChI | 1.06 | RYUNWBGPJCWGPJ-MRVPVSSYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C1C[C@@H](SC(=O)N1)c2ccccc2 |
| SMILES | CACTVS | 3.385 | O=C1C[CH](SC(=O)N1)c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | c1ccc(cc1)[C@H]2CC(=O)NC(=O)S2 |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1ccc(cc1)C2CC(=O)NC(=O)S2 |
