Carbon Tetrachloride → 5-amino-1-(2-chloroethyl)-1H-pyrazole-4-carbonitrile
Reaction equation
[C:31]([Cl:32])([Cl:33])([Cl:34])[Cl:35].[CH3:36][CH2:37][O:38][C:39]([CH3:40])=[O:41].[Cl:42][CH2:43][Cl:44].[NH2:1][c:2]1[c:3]([C:10]#[N:11])[cH:4][n:5][n:6]1[CH2:7][CH2:8][OH:9].[c:12]1([P:13]([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[cH:26][cH:27][cH:28][cH:29][cH:30]1>>[NH2:1][c:2]1[c:3]([C:10]#[N:11])[cH:4][n:5][n:6]1[CH2:7][CH2:8][Cl:32]Participants
6
Sources & evidence
- ORD record
- ord-043b3860aae54756b73e942ba2116c34
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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