QYT
Summary
| Name: | (5E)-5-(QUINOXALIN-6-YLMETHYLENE)-1,3-THIAZOLIDINE-2,4-DIONE |
| Synonyms: | 5-QUINOXALIN-6-YLMETHYLENE-THIAZOLIDINE-2,4-DIONE |
| Formula: | C12 H7 N3 O2 S |
| Formal charge: | 0 |
| Formula weight: | 257.268 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (5Z)-5-(quinoxalin-6-ylmethylidene)-1,3-thiazolidine-2,4-dione |
| OpenEye OEToolkits | 1.5.0 | 5-(quinoxalin-6-ylmethylidene)-1,3-thiazolidine-2,4-dione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C1C(\SC(=O)N1)=C\c3cc2nccnc2cc3 |
| SMILES_CANONICAL | CACTVS | 3.341 | O=C1NC(=O)/C(S1)=C/c2ccc3nccnc3c2 |
| SMILES | CACTVS | 3.341 | O=C1NC(=O)C(S1)=Cc2ccc3nccnc3c2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc2c(cc1C=C3C(=O)NC(=O)S3)nccn2 |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc2c(cc1C=C3C(=O)NC(=O)S3)nccn2 |
| InChI | InChI | 1.03 | InChI=1S/C12H7N3O2S/c16-11-10(18-12(17)15-11)6-7-1-2-8-9(5-7)14-4-3-13-8/h1-6H,(H,15,16,17)/b10-6- |
| InChIKey | InChI | 1.03 | SQWZFLMPDUSYGV-POHAHGRESA-N |
