Ethanol → 3-(4-Amino-3-chloro-5-trifluoromethyl-phenyl)-2-{[4-(2-oxo-1,2,4,5-tetrahydro-1,3-benzodiazepin-3-yl)-piperidin-1-carbonyl]-amino}-propionic Acid
Reaction equation
[CH3:43][CH2:44][OH:45].[NH2:1][c:2]1[c:3]([Cl:40])[cH:4][c:5]([CH2:12][CH:13]([C:14](=[O:15])[O:16][CH2:17][CH3:18])[NH:19][C:20](=[O:21])[N:22]2[CH2:23][CH2:24][CH:25]([N:28]3[C:29](=[O:39])[NH:30][c:31]4[c:32]([cH:35][cH:36][cH:37][cH:38]4)[CH2:33][CH2:34]3)[CH2:26][CH2:27]2)[cH:6][c:7]1[C:8]([F:9])([F:10])[F:11].[Na+:42].[OH-:41]>>[NH2:1][c:2]1[c:3]([Cl:40])[cH:4][c:5]([CH2:12][CH:13]([C:14](=[O:15])[OH:16])[NH:19][C:20](=[O:21])[N:22]2[CH2:23][CH2:24][CH:25]([N:28]3[C:29](=[O:39])[NH:30][c:31]4[c:32]([cH:35][cH:36][cH:37][cH:38]4)[CH2:33][CH2:34]3)[CH2:26][CH2:27]2)[cH:6][c:7]1[C:8]([F:9])([F:10])[F:11]Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-924bb9a625ba46cf97c21e2a6162b0c5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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