Water → HCID 49798592, compound
Reaction equation
[Br:24][c:25]1[c:26]([O:32][c:33]2[c:34]([CH3:42])[cH:35][c:36]([C:37]#[N:38])[cH:39][c:40]2[CH3:41])[n:27][c:28]([Cl:31])[n:29][cH:30]1.[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH2:10][CH:11]([NH2:14])[CH2:12][CH2:13]1.[CH3:44][N:45]1[CH2:46][CH2:47][CH2:48][C:49]1=[O:50].[CH:15]([N:16]([CH2:17][CH3:18])[CH:19]([CH3:20])[CH3:21])([CH3:22])[CH3:23].[OH2:43]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH2:10][CH:11]([NH:14][c:28]2[n:27][c:26]([O:32][c:33]3[c:34]([CH3:42])[cH:35][c:36]([C:37]#[N:38])[cH:39][c:40]3[CH3:41])[c:25]([Br:24])[cH:30][n:29]2)[CH2:12][CH2:13]1Participants
6
Sources & evidence
- ORD record
- ord-0e808190ab024e2e9430e6e60914da18
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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