R7W
Summary
| Name: | (5~{Z})-5-(quinolin-6-ylmethylidene)-1,3-thiazolidine-2,4-dione |
| Formula: | C13 H8 N2 O2 S |
| Formal charge: | 0 |
| Formula weight: | 256.28 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (5~{Z})-5-(quinolin-6-ylmethylidene)-1,3-thiazolidine-2,4-dione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C13H8N2O2S/c16-12-11(18-13(17)15-12)7-8-3-4-10-9(6-8)2-1-5-14-10/h1-7H,(H,15,16,17)/b11-7- |
| InChIKey | InChI | 1.03 | CBNBVOIOQAFDLQ-XFFZJAGNSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C1NC(=O)\C(S1)=C\c2ccc3ncccc3c2 |
| SMILES | CACTVS | 3.385 | O=C1NC(=O)C(S1)=Cc2ccc3ncccc3c2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc2cc(ccc2nc1)/C=C\3/C(=O)NC(=O)S3 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc2cc(ccc2nc1)C=C3C(=O)NC(=O)S3 |
