7QS
Summary
| Name: | (5R)-5-phenyl-1,3-thiazolidine-2,4-dione |
| Formula: | C9 H7 N O2 S |
| Formal charge: | 0 |
| Formula weight: | 193.222 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (5R)-5-phenyl-1,3-thiazolidine-2,4-dione |
| OpenEye OEToolkits | 2.0.6 | (5~{R})-5-phenyl-1,3-thiazolidine-2,4-dione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c1ccc(cc1)C2C(NC(=O)S2)=O |
| InChI | InChI | 1.03 | InChI=1S/C9H7NO2S/c11-8-7(13-9(12)10-8)6-4-2-1-3-5-6/h1-5,7H,(H,10,11,12)/t7-/m1/s1 |
| InChIKey | InChI | 1.03 | CJOPVUUYQFODBM-SSDOTTSWSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C1NC(=O)[C@H](S1)c2ccccc2 |
| SMILES | CACTVS | 3.385 | O=C1NC(=O)[CH](S1)c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1ccc(cc1)[C@@H]2C(=O)NC(=O)S2 |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1ccc(cc1)C2C(=O)NC(=O)S2 |
