Toluene → N-(4-(4-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)benzyl)piperazine-1-carbonyl)phenyl)-4-hydroxy-4-methylpentanamide
Reaction equation
[CH3:1][C:2]1([CH3:8])[CH2:3][CH2:4][C:5](=[O:7])[O:6]1.[CH3:45][N:46]([CH3:47])[CH:48]=[O:49].[CH3:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1.[CH3:9][Al:10]([CH3:11])[CH3:12].[NH2:13][c:14]1[cH:15][cH:16][c:17]([C:20](=[O:21])[N:22]2[CH2:23][CH2:24][N:25]([CH2:28][c:29]3[cH:30][cH:31][c:32]([C:35]([C:36]([F:37])([F:38])[F:39])([C:40]([F:41])([F:42])[F:43])[OH:44])[cH:33][cH:34]3)[CH2:26][CH2:27]2)[cH:18][cH:19]1>>[CH3:1][C:2]([CH2:3][CH2:4][C:5](=[O:7])[NH:13][c:14]1[cH:15][cH:16][c:17]([C:20](=[O:21])[N:22]2[CH2:23][CH2:24][N:25]([CH2:28][c:29]3[cH:30][cH:31][c:32]([C:35]([C:36]([F:37])([F:38])[F:39])([C:40]([F:41])([F:42])[F:43])[OH:44])[cH:33][cH:34]3)[CH2:26][CH2:27]2)[cH:18][cH:19]1)([OH:6])[CH3:8]Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-da961b4fca5745a99cd8486286df5a99
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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