- 2 of 2 defined stereocentres
(3S,4S)-N-(3-Cyano-4-fluorophenyl)-1-oxo-3-(3-pyridinyl)-2-(2,2,2-trifluoroethyl)-1,2,3,4-tetrahydro-4-isoquinolinecarboxamide
c1ccc2c(c1)[C@@H]([C@H](N(C2=O)CC(F)(F)F)c3cccnc3)C(=O)Nc4ccc(c(c4)C#N)F
InChI=1S/C24H16F4N4O2/c25-19-8-7-16(10-15(19)11-29)31-22(33)20-17-5-1-2-6-18(17)23(34)32(13-24(26,27)28)21(20)14-4-3-9-30-12-14/h1-10,12,20-21H,13H2,(H,31,33)/t20-,21+/m0/s1
VKCPFWKTFZAOTO-LEWJYISDSA-N
CSID:52084616, http://www.chemspider.com/Chemical-Structure.52084616.html (accessed 13:10, Dec 10, 2023)
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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