Try beta.chemspider
- 3 of 3 defined stereocentres
- Non-standard isotope
5-{[(2R,3S)-2-{[(1R)-1-[3,5-Bis(trifluoromethyl)phenyl](1,2-~2~H_2_)ethyl]oxy}-3-(4-fluorophenyl)-4-morpholinyl](~13~C)methyl}(5-~13~C)-2,4-dihydro-3H-1,2,4-triazol-3-one
C[C@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)O[C@@H]2[C@@H](N(CCO2)[13CH2][13c]3[nH]c(=O)[nH]n3)c4ccc(cc4)F
InChI=1S/C23H21F7N4O3/c1-12(14-8-15(22(25,26)27)10-16(9-14)23(28,29)30)37-20-19(13-2-4-17(24)5-3-13)34(6-7-36-20)11-18-31-21(35)33-32-18/h2-5,8-10,12,19-20H,6-7,11H2,1H3,(H2,31,32,33,35)/t12-,19+,20-/m1/s1/i1D,11+1,12D,18+1
ATALOFNDEOCMKK-IPWSJXMKSA-N
CSID:48058065, http://www.chemspider.com/Chemical-Structure.48058065.html (accessed 06:02, Apr 25, 2024)
Validated by Experts, Validated by Users, Non-Validated, Removed by Users
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
Click to predict properties on the Chemicalize site
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