| PDB CCD ID: | OPB |
| Number of entries in BioLiP: | 5 |
| Chemical formula: | C19 H20 N2 O3 |
| InChI: | InChI=1S/C19H20N2O3/c1-2-3-9-17-18(23)20(14-7-5-4-6-8-14)21(19(17)24)15-10-12-16(22)13-11-15/h4-8,10-13,17,22H,2-3,9H2,1H3/t17-/m0/s1 |
| InChIKey: | HFHZKZSRXITVMK-KRWDZBQOSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 1.5.0 | CCCCC1C(=O)N(N(C1=O)c2ccc(cc2)O)c3ccccc3 | | OpenEye OEToolkits 1.5.0 | CCCC[C@H]1C(=O)N(N(C1=O)c2ccc(cc2)O)c3ccccc3 | | CACTVS 3.341 | CCCC[C@H]1C(=O)N(N(C1=O)c2ccc(O)cc2)c3ccccc3 | | CACTVS 3.341 | CCCC[CH]1C(=O)N(N(C1=O)c2ccc(O)cc2)c3ccccc3 | | ACDLabs 10.04 | O=C2N(c1ccc(O)cc1)N(C(=O)C2CCCC)c3ccccc3 |
|
| Name: | 4-BUTYL-1-(4-HYDROXYPHENYL)-2-PHENYLPYRAZOLIDINE-3,5-DIONE;
OXYPHENBUTAZONE |
| ChEMBL: | CHEMBL1235001 |
| ZINC: | ZINC000001606505 |
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