Trifluoroacetic acid → 4-{3-[2-(1-Carbamoyl-5-trifluoromethyl-1H-indazol-3-ylamino)-acetylamino]-azetidin-1-yl}-cyclohexane carboxylic acid ethyl ester
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[CH:6]1[CH2:7][CH2:8][CH:9]([N:12]2[CH2:13][CH:14]([NH:16][C:17]([CH2:18][NH:19][c:20]3[n:21][n:22]([C:33]([NH:34][C:35]([CH3:36])([CH3:37])[CH3:38])=[O:39])[c:23]4[cH:24][cH:25][c:26]([C:29]([F:30])([F:31])[F:32])[cH:27][c:28]34)=[O:40])[CH2:15]2)[CH2:10][CH2:11]1.[F:41][C:42]([F:43])([F:44])[C:45]([OH:46])=[O:47]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[CH:6]1[CH2:7][CH2:8][CH:9]([N:12]2[CH2:13][CH:14]([NH:16][C:17]([CH2:18][NH:19][c:20]3[n:21][n:22]([C:33]([NH2:34])=[O:39])[c:23]4[cH:24][cH:25][c:26]([C:29]([F:30])([F:31])[F:32])[cH:27][c:28]34)=[O:40])[CH2:15]2)[CH2:10][CH2:11]1Participants
3
Sources & evidence
- ORD record
- ord-1db59b0096044aaaa784a8d7aaad1016
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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