Acetonitrile → 3-[3,5-Bis(trifluoromethyl)phenylamino]-2-(4-chlorophenylsulfonyl)-3-(5-cyclopropyl-2-methyl-2H-pyrazol-3-ylamino)-2-propenenitrile
Reaction equation
[CH3:32][CH2:33][N:34]([CH2:35][CH3:36])[CH2:37][CH3:38].[CH3:49][C:50]#[N:51].[F:1][C:2]([c:3]1[cH:4][c:5]([NH:13][C:14](=[C:15]([C:16]#[N:17])[S:18](=[O:19])(=[O:20])[c:21]2[cH:22][cH:23][c:24]([Cl:27])[cH:25][cH:26]2)[S:28][CH3:29])[cH:6][c:7]([C:9]([F:10])([F:11])[F:12])[cH:8]1)([F:30])[F:31].[NH2:39][c:40]1[cH:41][c:42]([CH:46]2[CH2:47][CH2:48]2)[n:43][n:44]1[CH3:45]>>[F:1][C:2]([c:3]1[cH:4][c:5]([NH:13][C:14](=[C:15]([C:16]#[N:17])[S:18](=[O:19])(=[O:20])[c:21]2[cH:22][cH:23][c:24]([Cl:27])[cH:25][cH:26]2)[NH:39][c:40]2[cH:41][c:42]([CH:46]3[CH2:47][CH2:48]3)[n:43][n:44]2[CH3:45])[cH:6][c:7]([C:9]([F:10])([F:11])[F:12])[cH:8]1)([F:30])[F:31]Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-84e9ca19cbe74f5f951fcccb0a42f500
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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