Phenol → HCID 69455603, compound
Reaction equation
[CH3:1][O:2][C:3]([c:4]1[c:5]([CH2:10][S:11][c:12]2[n:13][c:14]3[c:15]([n:16]2[CH2:17][CH2:18][OH:19])[cH:20][c:21]([CH3:25])[c:22]([CH3:24])[cH:23]3)[cH:6][cH:7][cH:8][cH:9]1)=[O:26].[CH3:46][N:47]1[CH2:48][CH2:49][O:50][CH2:51][CH2:52]1.[O:27]=[C:28]([O:29][CH2:30][CH3:31])[N:32]=[N:33][C:34]([O:35][CH2:36][CH3:37])=[O:38].[OH:39][c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1>>[CH3:1][O:2][C:3]([c:4]1[c:5]([CH2:10][S:11][c:12]2[n:13][c:14]3[c:15]([n:16]2[CH2:17][CH2:18][O:19][c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[cH:20][c:21]([CH3:25])[c:22]([CH3:24])[cH:23]3)[cH:6][cH:7][cH:8][cH:9]1)=[O:26]Participants
5
Sources & evidence
- ORD record
- ord-676db3aef0d24470be1d31e6b2ea9c6f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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