Ammonia → 5-[4-amino-2-[(6-chloroquinolin-4-yl)methyl]-7-(cyclopropylmethyl)-6-oxo-6,7-dihydro-2H-pyrazolo[3,4-d]pyrimidin-3-yl]-1-methyl-1H-pyrrole-3-carbonitrile
Reaction equation
[CH2:37]1[O:38][CH2:39][CH2:40][CH2:41]1.[CH3:42][OH:43].[Cl:1][c:2]1[cH:3][c:4]2[c:5]([CH2:12][n:13]3[n:14][c:15]4[n:16]([CH2:32][CH:33]5[CH2:34][CH2:35]5)[c:17](=[O:31])[nH:18][c:19](=[S:30])[c:20]4[c:21]3-[c:22]3[cH:23][c:24]([C:28]#[N:29])[cH:25][n:26]3[CH3:27])[cH:6][cH:7][n:8][c:9]2[cH:10][cH:11]1.[Cl:44][Hg:45][Cl:46].[NH3:36]>>[Cl:1][c:2]1[cH:3][c:4]2[c:5]([CH2:12][n:13]3[n:14][c:15]4[n:16]([CH2:32][CH:33]5[CH2:34][CH2:35]5)[c:17](=[O:31])[n:18][c:19]([NH2:36])[c:20]4[c:21]3-[c:22]3[cH:23][c:24]([C:28]#[N:29])[cH:25][n:26]3[CH3:27])[cH:6][cH:7][n:8][c:9]2[cH:10][cH:11]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-a897d3de790f481eb24e7379a33d6222
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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