Reaction equation
[CH2:28]1[CH2:29][CH2:30][C:31]2=[N:36][CH2:35][CH2:34][CH2:33][N:32]2[CH2:37][CH2:38]1.[CH3:19][c:20]1[cH:21][cH:22][c:23]([CH2:26][OH:27])[cH:24][n:25]1.[CH3:39][O:40][CH2:41][CH2:42][O:43][CH3:44].[ClH:18].[NH2:1][c:2]1[n:3][c:4]([S:15]([CH3:16])=[O:17])[c:5]([C:13]#[N:14])[c:6](-[c:8]2[o:9][cH:10][cH:11][cH:12]2)[n:7]1>>[NH2:1][c:2]1[n:3][c:4]([O:27][CH2:26][c:23]2[cH:22][cH:21][c:20]([CH3:19])[n:25][cH:24]2)[c:5]([C:13]#[N:14])[c:6](-[c:8]2[o:9][cH:10][cH:11][cH:12]2)[n:7]1Participants
6
Sources & evidence
- ORD record
- ord-4d772bb63b584d2cb10a7dd86d6167db
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Linked notes
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