HCID 67411141, compound → HCID 73230097, compound
Reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([F:18])[c:6](-[c:8]2[n:9][c:10]3[c:11]([c:12]([OH:14])[n:13]2)[CH2:15][CH2:16][CH2:17]3)[cH:7]1.[CH:19]([c:20]1[cH:21][cH:22][n:23](-[c:24]2[cH:25][c:26]([O:27][CH:38]3[CH2:39][CH:40]4[C:41](=[O:67])[N:42]([CH3:66])[CH2:43][CH2:44][CH2:45][CH2:46][CH:47]=[CH:48][CH:49]5[CH2:50][C:51]5([C:57](=[O:58])[NH:59][S:60](=[O:61])(=[O:62])[N:63]([CH3:64])[CH3:65])[NH:52][C:53](=[O:56])[CH:54]4[CH2:55]3)[c:28]3[c:29]([c:30]([CH3:31])[c:32]([O:33][CH3:34])[cH:35][cH:36]3)[n:37]2)[n:68]1)([CH3:69])[CH3:70]>>[Br:1][c:2]1[cH:3][cH:4][c:5]([F:18])[c:6](-[c:8]2[n:9][c:10]3[c:11]([c:12]([O:14][CH:38]4[CH2:39][CH:40]5[C:41](=[O:67])[N:42]([CH3:66])[CH2:43][CH2:44][CH2:45][CH2:46][CH:47]=[CH:48][CH:49]6[CH2:50][C:51]6([C:57](=[O:58])[NH:59][S:60](=[O:61])(=[O:62])[N:63]([CH3:64])[CH3:65])[NH:52][C:53](=[O:56])[CH:54]5[CH2:55]4)[n:13]2)[CH2:15][CH2:16][CH2:17]3)[cH:7]1Participants
3
Sources & evidence
- ORD record
- ord-b7815962c5354d58b89181cf3a2a58f7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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