Reaction equation
[CH3:1][S:2](=[O:3])[c:4]1[n:5][n:6]2[c:7]([cH:8][n:9]1)[cH:10][cH:11][c:12]2-[c:13]1[c:14]([O:19][CH3:20])[cH:15][cH:16][cH:17][cH:18]1.[CH3:45][O:46][CH2:47][CH:48]([OH:49])[CH3:50].[CH:21]([N:22]([CH2:23][CH3:24])[CH:25]([CH3:26])[CH3:27])([CH3:28])[CH3:29].[NH2:30][c:31]1[cH:32][c:33]([C:37](=[O:38])[N:39]2[CH2:40][CH2:41][O:42][CH2:43][CH2:44]2)[cH:34][cH:35][cH:36]1>>[c:4]1([NH:30][c:31]2[cH:32][c:33]([C:37](=[O:38])[N:39]3[CH2:40][CH2:41][O:42][CH2:43][CH2:44]3)[cH:34][cH:35][cH:36]2)[n:5][n:6]2[c:7]([cH:8][n:9]1)[cH:10][cH:11][c:12]2-[c:13]1[c:14]([O:19][CH3:20])[cH:15][cH:16][cH:17][cH:18]1Participants
5
Sources & evidence
- ORD record
- ord-6ee300200c5948eab8b1318fc250244b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Linked notes
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