| PDB CCD ID: | 2RF |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C16 H10 Cl2 N2 O3 |
| InChI: | InChI=1S/C16H10Cl2N2O3/c17-9-3-1-2-8(6-9)13-14(16(23)20-15(13)22)19-10-4-5-12(21)11(18)7-10/h1-7,21H,(H2,19,20,22,23) |
| InChIKey: | YYGKSMKAYKZSBC-UHFFFAOYSA-N |
| SMILES: | | Software | SMILES |
|---|
| ACDLabs 12.01 | O=C2C(Nc1cc(Cl)c(O)cc1)=C(C(=O)N2)c3cccc(Cl)c3 | | CACTVS 3.385 | Oc1ccc(NC2=C(C(=O)NC2=O)c3cccc(Cl)c3)cc1Cl | | OpenEye OEToolkits 1.7.6 | c1cc(cc(c1)Cl)C2=C(C(=O)NC2=O)Nc3ccc(c(c3)Cl)O |
|
| Name: | 3-[(3-chloro-4-hydroxyphenyl)amino]-4-(3-chlorophenyl)-1H-pyrrole-2,5-dione |
| ChEMBL: | CHEMBL160333 |
| ZINC: | ZINC000014946002 |
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