SpectraBase Spectrum ID |
Dh3auqmdy8O |
Name |
(2R,Ss)-2-[(1S)-1-(4-Methoxyphenylamino)-1-(4-trifluoromethylphenyl)methyl]-1,3-benzoxathiole-3(2H)-oxide |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H18F3NO3S |
InChI |
InChI=1S/C22H18F3NO3S/c1-28-17-12-10-16(11-13-17)26-20(14-6-8-15(9-7-14)22(23,24)25)21-29-18-4-2-3-5-19(18)30(21)27/h2-13,20-21,26H,1H3/t20-,21+,30?/m0/s1 |
InChIKey |
APPQBMMCXCOSDA-HFHQHIJTSA-N |
Molecular Weight |
433.445 g/mol |
SMILES |
N([C@]([C@]1(S(c2c(cccc2)O1)=O)[H])(c1ccc(C(F)(F)F)cc1)[H])c1ccc(cc1)OC |
SPLASH |
splash10-001i-0190100000-02d95121639e32a95c7d |
Source of Spectrum |
U1-2002-3399-7 |
Wiley ID |
1523295 |