Acetate → 2-[4-amino-3-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2,6-difluoroanilino]-2-(4-fluorophenyl)ethanol
Reaction equation
[CH2:41]1[O:42][CH2:43][CH2:44][CH2:45]1.[CH3:35][C:36](=[O:37])[O-:38].[CH3:39][OH:40].[CH:3]1([c:6]2[cH:7][c:8]([NH:11][c:12]3[c:13]([F:33])[c:14]([NH:22][CH:23]([CH2:24][OH:25])[c:26]4[cH:27][cH:28][c:29]([F:32])[cH:30][cH:31]4)[c:15]([F:21])[cH:16][c:17]3[N+:18]([O-:19])=[O:20])[n:9][nH:10]2)[CH2:4][CH2:5]1.[Cl-:1].[NH4+:2].[NH4+:34].[Zn:46]>>[CH:3]1([c:6]2[cH:7][c:8]([NH:11][c:12]3[c:13]([F:33])[c:14]([NH:22][CH:23]([CH2:24][OH:25])[c:26]4[cH:27][cH:28][c:29]([F:32])[cH:30][cH:31]4)[c:15]([F:21])[cH:16][c:17]3[NH2:18])[n:9][nH:10]2)[CH2:4][CH2:5]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-119dc65699a54bbe95e0938eb76a6f60
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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