PDB CCD ID: | 17R | ||||||||||||
Number of entries in BioLiP: | 4 | ||||||||||||
Chemical formula: | C20 H19 F4 N5 O2 S | ||||||||||||
InChI: | InChI=1S/C20H19F4N5O2S/c1-14-11-27(19-6-5-15(21)9-18(19)20(22,23)24)7-8-29(14)32(30,31)17-4-2-3-16(10-17)28-13-25-12-26-28/h2-6,9-10,12-14H,7-8,11H2,1H3/t14-/m1/s1 | ||||||||||||
InChIKey: | ALJLAOVBUJZEDK-CQSZACIVSA-N | ||||||||||||
SMILES: |
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Name: | (2R)-4-[4-fluoro-2-(trifluoromethyl)phenyl]-2-methyl-1-{[3-(1H-1,2,4-triazol-1-yl)phenyl]sulfonyl}piperazine; (R)-1-(3-(1H-1,2,4-triazol-1-yl)phenylsulfonyl)-4-(4-fluoro-2-(trifluoromethyl)phenyl)-2-methylpiperazine | ||||||||||||
ChEMBL: | CHEMBL518303 | ||||||||||||
ZINC: | ZINC000039290216 |

Reference: