Hydrochloric Acid → Tert-butyl 3-(6-{(3,5-bis-trifluoromethyl-benzyl)-[2-(butyl-ethyl-amino)-5-trifluoromethyl-benzyl]-amino}-pyrimidin-4-ylamino)-propionate
Reaction equation
[C:43]([CH3:44])([CH3:45])([CH3:46])[O:47][C:48]([CH2:49][CH2:50][NH2:51])=[O:52].[CH2:53]([N:54]([CH:55]([CH3:56])[CH3:57])[CH:58]([CH3:59])[CH3:60])[CH3:61].[CH3:62][CH2:63][O:64][C:65](=[O:66])[CH3:67].[CH3:68][c:69]1[cH:70][cH:71][cH:72][cH:73][cH:74]1.[ClH:42].[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:6][N:7]([c:8]2[n:9][cH:10][n:11][c:12]([Cl:14])[cH:13]2)[CH2:15][c:16]2[c:17]([N:26]([CH2:27][CH3:28])[CH2:29][CH2:30][CH2:31][CH3:32])[cH:18][cH:19][c:20]([C:22]([F:23])([F:24])[F:25])[cH:21]2)[cH:33][c:34]([C:36]([F:37])([F:38])[F:39])[cH:35]1)([F:40])[F:41]>>[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:6][N:7]([c:8]2[n:9][cH:10][n:11][c:12]([NH:51][CH2:50][CH2:49][C:48]([O:47][C:43]([CH3:44])([CH3:45])[CH3:46])=[O:52])[cH:13]2)[CH2:15][c:16]2[c:17]([N:26]([CH2:27][CH3:28])[CH2:29][CH2:30][CH2:31][CH3:32])[cH:18][cH:19][c:20]([C:22]([F:23])([F:24])[F:25])[cH:21]2)[cH:33][c:34]([C:36]([F:37])([F:38])[F:39])[cH:35]1)([F:40])[F:41]Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-c9424acbf4ba4d208f69eef5c94e8ca0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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