HCID 19428507, compound → HCID 178421735, compound
Reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([S:6]([O:7][CH2:12][C:13]([CH:14]2[CH:15]([CH3:34])[CH2:16][CH:17]3[CH:18]4[CH2:19][CH2:20][C:21]5=[CH:22][C:23](=[O:33])[CH:24]=[CH:25][C:26]5([CH3:27])[C:28]4=[CH:29][CH2:30][C:31]23[CH3:32])=[O:35])(=[O:8])=[O:9])[cH:10][cH:11]1.[CH:36]1([NH:41][c:42]2[n:43][c:44]([N:54]3[CH2:55][CH2:56][NH:57][CH2:58][CH2:59]3)[cH:45][c:46]([NH:48][CH:49]3[CH2:50][CH2:51][CH2:52][CH2:53]3)[n:47]2)[CH2:37][CH2:38][CH2:39][CH2:40]1>>[CH2:12]([C:13]([CH:14]1[CH:15]([CH3:34])[CH2:16][CH:17]2[CH:18]3[CH2:19][CH2:20][C:21]4=[CH:22][C:23](=[O:33])[CH:24]=[CH:25][C:26]4([CH3:27])[C:28]3=[CH:29][CH2:30][C:31]12[CH3:32])=[O:35])[N:57]1[CH2:56][CH2:55][N:54]([c:44]2[n:43][c:42]([NH:41][CH:36]3[CH2:37][CH2:38][CH2:39][CH2:40]3)[n:47][c:46]([NH:48][CH:49]3[CH2:50][CH2:51][CH2:52][CH2:53]3)[cH:45]2)[CH2:59][CH2:58]1Participants
3
Sources & evidence
- ORD record
- ord-da68a604a78e49a18362cb20aebe7226
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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