Ammonia → 3-Amino-1-(3-(trifluoromethyl)-5,6-dihydro(1,2,4)triazolo(4,3-a)pyrazin-7(8H)-yl)-4-(2,4,5-trifluorophenyl)butan-1-one
Reaction equation
[BH3:4].[CH2:39]1[O:40][CH2:41][CH2:42][CH2:43]1.[CH3:1][S:2][CH3:3].[CH3:5][S:6](=[O:7])(=[O:8])[OH:9].[CH:45]([OH:46])([CH3:47])[CH3:48].[NH3:38].[O:10]=[C:11]([CH:12]=[C:13]([CH2:14][c:15]1[c:16]([F:23])[cH:17][c:18]([F:22])[c:19]([F:21])[cH:20]1)[NH2:24])[N:25]1[CH2:26][c:27]2[n:28]([c:31]([C:34]([F:35])([F:36])[F:37])[n:32][n:33]2)[CH2:29][CH2:30]1.[OH2:44]>>[O:10]=[C:11]([CH2:12][CH:13]([CH2:14][c:15]1[c:16]([F:23])[cH:17][c:18]([F:22])[c:19]([F:21])[cH:20]1)[NH2:24])[N:25]1[CH2:26][c:27]2[n:28]([c:31]([C:34]([F:35])([F:36])[F:37])[n:32][n:33]2)[CH2:29][CH2:30]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-0380ea8b946941ed81af5ec6b46cd3de
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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