HCID 53257946, compound → HCID 178490141, compound
Reaction equation
[Br:36][c:37]1[n:38][nH:39][c:40]2[n:41][cH:42][n:43][c:44]([Cl:46])[c:45]12.[CH3:1][O:2][c:3]1[cH:4][c:5]([CH2:9][CH2:10][NH:11][c:12]2[n:13][cH:14][cH:15][c:16](-[c:18]3[cH:19][c:20]4[cH:21][cH:22][c:23]([O:34][CH3:35])[cH:24][c:25]4[c:26]([N:28]4[CH2:29][CH2:30][NH:31][CH2:32][CH2:33]4)[cH:27]3)[n:17]2)[cH:6][cH:7][cH:8]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]([CH2:9][CH2:10][NH:11][c:12]2[n:13][cH:14][cH:15][c:16](-[c:18]3[cH:19][c:20]4[cH:21][cH:22][c:23]([O:34][CH3:35])[cH:24][c:25]4[c:26]([N:28]4[CH2:29][CH2:30][N:31]([c:44]5[n:43][cH:42][n:41][c:40]6[nH:39][n:38][c:37]([Br:36])[c:45]65)[CH2:32][CH2:33]4)[cH:27]3)[n:17]2)[cH:6][cH:7][cH:8]1Participants
3
Sources & evidence
- ORD record
- ord-b9e3950b39f14335b76e8ebf97304b36
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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