1,2-Dichloroethane → 2-Chloro-6-{[3-(2-pyridinyl)-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]carbonyl}benzonitrile
Reaction equation
[CH2:1]([Cl:2])[CH2:3][Cl:4].[CH3:45][N:46]([CH3:47])[CH:48]=[O:49].[Cl:30][c:31]1[c:32]([C:40]#[N:41])[c:33]([C:34](=[O:35])[OH:36])[cH:37][cH:38][cH:39]1.[Cl:42][CH2:43][Cl:44].[OH:5][n:6]1[c:7]2[c:8]([cH:9][cH:10][cH:11][cH:12]2)[n:13][n:14]1.[n:15]1[c:16](-[c:21]2[n:22][n:23][c:24]3[n:25]2[CH2:26][CH2:27][NH:28][CH2:29]3)[cH:17][cH:18][cH:19][cH:20]1>>[n:15]1[c:16](-[c:21]2[n:22][n:23][c:24]3[n:25]2[CH2:26][CH2:27][N:28]([C:34]([c:33]2[c:32]([C:40]#[N:41])[c:31]([Cl:30])[cH:39][cH:38][cH:37]2)=[O:35])[CH2:29]3)[cH:17][cH:18][cH:19][cH:20]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-657fc5082b074af58da3cc76768d801c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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