Ammonium → 2-[3,5-Bis(trifluoromethyl)phenyl]-N-[4-(4-fluoro-2-methylphenyl)-6-(6-oxohexahydropyrrolo[1,2-a]pyrazin-2(1H)-yl)-3-pyridinyl]-N,2-dimethylpropanamide
Reaction equation
[C:47](=[O:48])([O-:49])[O-:50].[CH2:37]1[CH:38]2[N:39]([CH2:40][CH2:41][NH:42]1)[C:43](=[O:46])[CH2:44][CH2:45]2.[CH3:55][S:56]([CH3:57])=[O:58].[Cl-:53].[F:1][C:2]([c:3]1[cH:4][c:5]([C:13]([C:14](=[O:15])[N:16]([CH3:17])[c:18]2[cH:19][n:20][c:21]([Cl:32])[cH:22][c:23]2-[c:24]2[c:25]([CH3:31])[cH:26][c:27]([F:30])[cH:28][cH:29]2)([CH3:33])[CH3:34])[cH:6][c:7]([C:9]([F:10])([F:11])[F:12])[cH:8]1)([F:35])[F:36].[K+:51].[K+:52].[NH4+:54]>>[F:1][C:2]([c:3]1[cH:4][c:5]([C:13]([C:14](=[O:15])[N:16]([CH3:17])[c:18]2[cH:19][n:20][c:21]([N:42]3[CH2:37][CH:38]4[N:39]([CH2:40][CH2:41]3)[C:43](=[O:46])[CH2:44][CH2:45]4)[cH:22][c:23]2-[c:24]2[c:25]([CH3:31])[cH:26][c:27]([F:30])[cH:28][cH:29]2)([CH3:33])[CH3:34])[cH:6][c:7]([C:9]([F:10])([F:11])[F:12])[cH:8]1)([F:35])[F:36]Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-e5bdb230c5c94cc5bb3b4d3f4982826b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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