| PDB CCD ID: | R7W |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C13 H8 N2 O2 S |
| InChI: | 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: | CBNBVOIOQAFDLQ-XFFZJAGNSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 2.0.7 | c1cc2cc(ccc2nc1)/C=C\3/C(=O)NC(=O)S3 | | CACTVS 3.385 | O=C1NC(=O)C(S1)=Cc2ccc3ncccc3c2 | | CACTVS 3.385 | O=C1NC(=O)\C(S1)=C\c2ccc3ncccc3c2 | | OpenEye OEToolkits 2.0.7 | c1cc2cc(ccc2nc1)C=C3C(=O)NC(=O)S3 |
|
| Name: | (5~{Z})-5-(quinolin-6-ylmethylidene)-1,3-thiazolidine-2,4-dione |
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