| PDB CCD ID: | SUZ |
| Number of entries in BioLiP: | 13 |
| Chemical formula: | C20 H17 F O3 S |
| InChI: | InChI=1S/C20H17FO3S/c1-12-17(9-13-3-6-15(7-4-13)25(2)24)16-8-5-14(21)10-19(16)18(12)11-20(22)23/h3-10H,11H2,1-2H3,(H,22,23)/b17-9-/t25-/m1/s1 |
| InChIKey: | MLKXDPUZXIRXEP-LQVWSKNFSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 1.7.0 | CC\1=C(c2cc(ccc2/C1=C\c3ccc(cc3)[S@](=O)C)F)CC(=O)O | | CACTVS 3.370 | CC1=C(CC(O)=O)c2cc(F)ccc2\C1=C/c3ccc(cc3)[S@@](C)=O | | CACTVS 3.370 | CC1=C(CC(O)=O)c2cc(F)ccc2C1=Cc3ccc(cc3)[S](C)=O | | ACDLabs 12.01 | O=S(c1ccc(cc1)/C=C3\c2ccc(F)cc2C(=C3C)CC(=O)O)C | | OpenEye OEToolkits 1.7.0 | CC1=C(c2cc(ccc2C1=Cc3ccc(cc3)S(=O)C)F)CC(=O)O |
|
| Name: | [(1Z)-5-fluoro-2-methyl-1-{4-[methylsulfinyl]benzylidene}-1H-inden-3-yl]acetic acid;
SULINDAC |
| ChEMBL: | CHEMBL4525719 |
| ZINC: | ZINC000004475353 |
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