SpectraBase Spectrum ID |
JXjGUuq9HrD |
Name |
1-[3,5-Bis(trifluoromethyl)phenyl-3-[(1S,2S)-2-(piperidin-1-yl)cyclohexyl]thiourea |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C20H25F6N3S |
InChI |
InChI=1S/C20H25F6N3S/c21-19(22,23)13-10-14(20(24,25)26)12-15(11-13)27-18(30)28-16-6-2-3-7-17(16)29-8-4-1-5-9-29/h10-12,16-17H,1-9H2,(H2,27,28,30)/t16-,17-/m0/s1 |
InChIKey |
JPNIOHVSKNMMJH-IRXDYDNUSA-N |
Molecular Weight |
453.491 g/mol |
SMILES |
N(C(N[C@@]1([C@@](N2CCCCC2)(CCCC1)[H])[H])=S)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 |
SPLASH |
splash10-01bi-3900100000-dbec3b98c7b5ccbe8b30 |
Source of Spectrum |
F-66-6355-11a |
Wiley ID |
1683664 |