4-(4-Pyridin-3-yl-pyrimidin-2-ylamino)-benzoic acid ethyl ester → HCID 68850957, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([c:5]1[cH:6][c:7]([NH:12][c:13]2[n:14][cH:15][cH:16][c:17](-[c:19]3[n:20][cH:21][cH:22][n:23][c:24]3[CH3:25])[n:18]2)[c:8]([CH3:11])[cH:9][cH:10]1)=[O:26].[CH2:27]([O:28][C:29](=[O:30])[c:31]1[cH:32][cH:33][c:34]([NH:35][c:36]2[n:37][c:38](-[c:39]3[cH:40][n:41][cH:42][cH:43][cH:44]3)[cH:45][cH:46][n:47]2)[cH:48][cH:49]1)[CH3:50]>>[O:3]=[C:4]([c:5]1[cH:6][c:7]([NH:12][c:13]2[n:14][cH:15][cH:16][c:17](-[c:19]3[n:20][cH:21][cH:22][n:23][c:24]3[CH3:25])[n:18]2)[c:8]([CH3:11])[cH:9][cH:10]1)[OH:26]Participants
3
Sources & evidence
- ORD record
- ord-c3f84e163454477eacf8f1567187e51f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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