Trifluoroacetic acid → 2-(1-Ethyl-5-trifluoromethyl-1H-indazol-3-ylamino)-N-[1-(4-isopropyl-cyclohexyl)-azetidin-3-yl]-acetamide
Reaction equation
[CH:32]([CH3:33])([CH3:34])[CH:35]1[CH2:36][CH2:37][C:38](=[O:41])[CH2:39][CH2:40]1.[F:25][C:26]([F:27])([F:28])[C:29]([OH:30])=[O:31].[NH:1]1[CH2:2][CH:3]([NH:5][C:6]([CH2:7][NH:8][c:9]2[n:10][n:11]([CH2:22][CH3:23])[c:12]3[cH:13][cH:14][c:15]([C:18]([F:19])([F:20])[F:21])[cH:16][c:17]23)=[O:24])[CH2:4]1>>[N:1]1([CH:38]2[CH2:37][CH2:36][CH:35]([CH:32]([CH3:33])[CH3:34])[CH2:40][CH2:39]2)[CH2:2][CH:3]([NH:5][C:6]([CH2:7][NH:8][c:9]2[n:10][n:11]([CH2:22][CH3:23])[c:12]3[cH:13][cH:14][c:15]([C:18]([F:19])([F:20])[F:21])[cH:16][c:17]23)=[O:24])[CH2:4]1Participants
4
Sources & evidence
- ORD record
- ord-e736e8034aed47e89fd76118ce42a018
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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