Dimethylamine → 5-Amino-1-(6-chloro-1,1,3,3-tetrafluoro-1,3-dihydroisobenzofuran-5-yl)-3-cyano-4-trifluoromethylsulfenylpyrazole
Reaction equation
[CH3:42][NH:43][CH3:44].[CH3:49][c:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1.[F:23][C:24]([S:25]([O-:26])=[O:27])([F:28])[F:29].[NH2:1][c:2]1[cH:3][c:4]([C:21]#[N:22])[n:5][n:6]1-[c:7]1[cH:8][c:9]2[c:13]([cH:14][c:15]1[Cl:16])[C:12]([F:17])([F:18])[O:11][C:10]2([F:19])[F:20].[Na+:30].[OH2:56].[OH:31][S:32]([c:33]1[cH:34][cH:35][c:36]([CH3:37])[cH:38][cH:39]1)(=[O:40])=[O:41].[S:45]([Cl:46])([Cl:47])=[O:48]>>[NH2:1][c:2]1[c:3]([S:25][C:24]([F:23])([F:28])[F:29])[c:4]([C:21]#[N:22])[n:5][n:6]1-[c:7]1[cH:8][c:9]2[c:13]([cH:14][c:15]1[Cl:16])[C:12]([F:17])([F:18])[O:11][C:10]2([F:19])[F:20]Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-0016b48d5a034f5aad3ec874d71e2bdb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
Loading…