| PDB CCD ID: | 72Q |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C17 H12 F3 N O4 S |
| InChI: | InChI=1S/C17H12F3NO4S/c1-26(23,24)12-3-2-11(13-14(12)17(22)16(20)15(13)19)25-10-5-8(7-21)4-9(18)6-10/h2-6,15-17,22H,1H3/t15-,16-,17+/m1/s1 |
| InChIKey: | LOMMPXLFBTZENJ-ZACQAIPSSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 2.0.5 | CS(=O)(=O)c1ccc(c2c1C(C(C2F)F)O)Oc3cc(cc(c3)F)C#N | | ACDLabs 12.01 | N#Cc1cc(cc(c1)F)Oc2ccc(c3c2C(F)C(C3O)F)S(C)(=O)=O | | CACTVS 3.385 | C[S](=O)(=O)c1ccc(Oc2cc(F)cc(c2)C#N)c3[C@@H](F)[C@@H](F)[C@@H](O)c13 | | OpenEye OEToolkits 2.0.5 | CS(=O)(=O)c1ccc(c2c1[C@@H]([C@@H]([C@@H]2F)F)O)Oc3cc(cc(c3)F)C#N | | CACTVS 3.385 | C[S](=O)(=O)c1ccc(Oc2cc(F)cc(c2)C#N)c3[CH](F)[CH](F)[CH](O)c13 |
|
| Name: | 3-{[(1S,2S,3R)-2,3-difluoro-1-hydroxy-7-(methylsulfonyl)-2,3-dihydro-1H-inden-4-yl]oxy}-5-fluorobenzonitrile;
Belzutifan |
| ChEMBL: | CHEMBL4585668 |
| DrugBank: | DB15463 |
| ZINC: | ZINC000584905085 |
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