Ethanol → 1-[2-((3,5-Bis-trifluoromethyl-benzyl)-{2-[ethyl-(2-methoxy-ethyl)-amino]-5-trifluoromethyl-benzyl}-amino)-pyrimidin-5-yl]-piperidine-4-carboxylic acid
Reaction equation
[CH3:54][CH2:55][O:56][C:57](=[O:58])[CH3:59].[CH3:60][CH2:61][OH:62].[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:6][N:7]([c:8]2[n:9][cH:10][c:11]([N:14]3[CH2:15][CH2:16][CH:17]([C:20](=[O:21])[O:22][CH2:23][CH3:24])[CH2:18][CH2:19]3)[cH:12][n:13]2)[CH2:25][c:26]2[c:27]([N:36]([CH2:37][CH2:38][O:39][CH3:40])[CH2:41][CH3:42])[cH:28][cH:29][c:30]([C:32]([F:33])([F:34])[F:35])[cH:31]2)[cH:43][c:44]([C:46]([F:47])([F:48])[F:49])[cH:45]1)([F:50])[F:51].[Na+:53].[OH-:52]>>[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:6][N:7]([c:8]2[n:9][cH:10][c:11]([N:14]3[CH2:15][CH2:16][CH:17]([C:20](=[O:21])[OH:22])[CH2:18][CH2:19]3)[cH:12][n:13]2)[CH2:25][c:26]2[c:27]([N:36]([CH2:37][CH2:38][O:39][CH3:40])[CH2:41][CH3:42])[cH:28][cH:29][c:30]([C:32]([F:33])([F:34])[F:35])[cH:31]2)[cH:43][c:44]([C:46]([F:47])([F:48])[F:49])[cH:45]1)([F:50])[F:51]Participants
6
Sources & evidence
- ORD record
- ord-464afef2541b4c39950c7bbe01775860
- Source dataset
- Test data from https://doi.org/10.1039/C8SC04228D
Reaction notes
Loading…