Ammonium → Methyl 2-[4-[4-(6-carbamoyl-3,5-dimethylpyrazin-2-yl)-2-fluorophenyl]-3-chlorophenyl]prop-2-enoate
Reaction equation
[C:6]([NH2:7])(=[O:8])[c:9]1[c:10]([CH3:37])[n:11][c:12]([CH3:36])[c:13](-[c:15]2[cH:16][c:17]([F:35])[c:18](-[c:21]3[c:22]([Cl:34])[cH:23][c:24]([CH:27]([C:28](=[O:29])[O:30][CH3:31])[CH2:32][OH:33])[cH:25][cH:26]3)[cH:19][cH:20]2)[n:14]1.[CH3:1][S:2](=[O:3])(=[O:4])[Cl:5].[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[CH3:52][CH2:53][O:54][C:55](=[O:56])[CH3:57].[Cl-:45].[NH4+:46].[O:47]1[CH2:48][CH2:49][CH2:50][CH2:51]1.[OH2:58]>>[C:6]([NH2:7])(=[O:8])[c:9]1[c:10]([CH3:37])[n:11][c:12]([CH3:36])[c:13](-[c:15]2[cH:16][c:17]([F:35])[c:18](-[c:21]3[c:22]([Cl:34])[cH:23][c:24]([C:27]([C:28](=[O:29])[O:30][CH3:31])=[CH2:32])[cH:25][cH:26]3)[cH:19][cH:20]2)[n:14]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-116891853e7d4868b3e1845c459f9773
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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