Reaction equation
[CH3:1][C:2]1([CH3:37])[O:3][c:4]2[c:5]([c:6]([OH:30])[cH:7][c:8]([CH:10]([CH3:11])[CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH3:29])[cH:9]2)-[c:31]2[c:32]1[cH:33][cH:34][n:35][cH:36]2.[CH:51]1([N:52]=[C:53]=[N:54][CH:55]2[CH2:56][CH2:57][CH2:58][CH2:59][CH2:60]2)[CH2:61][CH2:62][CH2:63][CH2:64][CH2:65]1.[ClH:38].[N:39]1([CH2:45][CH2:46][CH2:47][C:48](=[O:49])[OH:50])[CH2:40][CH2:41][CH2:42][CH2:43][CH2:44]1>>[CH3:1][C:2]1([CH3:37])[O:3][c:4]2[c:5]([c:6]([O:30][C:48]([CH2:47][CH2:46][CH2:45][N:39]3[CH2:40][CH2:41][CH2:42][CH2:43][CH2:44]3)=[O:49])[cH:7][c:8]([CH:10]([CH3:11])[CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH3:29])[cH:9]2)-[c:31]2[c:32]1[cH:33][cH:34][n:35][cH:36]2.[ClH:38]Participants
6
Reactant 4
Product 2
Sources & evidence
- ORD record
- ord-0ca7fe73b05842f6bd3fd2cc79bb03fd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Linked notes
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