Ethyl 4-oxocyclohexanecarboxylate → 4-{3-[2-(1-Benzyl-5-trifluoromethyl-1H-indazol-3-ylamino)-acetylamino]-azetidin-1-yl}-cyclohexane carboxylic acid ethyl ester
Reaction equation
[CH2:30]([CH3:31])[O:32][C:33](=[O:34])[CH:35]1[CH2:36][CH2:37][C:38](=[O:41])[CH2:39][CH2:40]1.[NH:1]1[CH2:2][CH:3]([NH:5][C:6]([CH2:7][NH:8][c:9]2[n:10][n:11]([CH2:22][c:23]3[cH:24][cH:25][cH:26][cH:27][cH:28]3)[c:12]3[cH:13][cH:14][c:15]([C:18]([F:19])([F:20])[F:21])[cH:16][c:17]23)=[O:29])[CH2:4]1>>[N:1]1([CH:38]2[CH2:37][CH2:36][CH:35]([C:33]([O:32][CH2:30][CH3:31])=[O: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][c:23]3[cH:24][cH:25][cH:26][cH:27][cH:28]3)[c:12]3[cH:13][cH:14][c:15]([C:18]([F:19])([F:20])[F:21])[cH:16][c:17]23)=[O:29])[CH2:4]1Participants
3
Sources & evidence
- ORD record
- ord-ae7659ce94d7424f99f54e8546c7cd64
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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