Toluene → HCID 22405331, compound
Reaction equation
[CH2:1]([Sn:2]([CH2:3][CH2:4][CH2:5][CH3:28])([c:6]1[cH:7][cH:8][c:9]([C:10](=[O:11])[N:12]2[CH2:13][c:14]3[n:15]([cH:23][cH:24][cH:25]3)[CH2:16][c:17]3[c:18]2[cH:19][cH:20][cH:21][cH:22]3)[cH:26][cH:27]1)[CH2:29][CH2:30][CH2:31][CH3:32])[CH2:33][CH2:34][CH3:35].[CH3:45][c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1.[F:36][c:37]1[cH:38][c:39]([Br:44])[cH:40][c:41]([F:43])[cH:42]1>>[c:6]1(-[c:39]2[cH:38][c:37]([F:36])[cH:42][c:41]([F:43])[cH:40]2)[cH:7][cH:8][c:9]([C:10](=[O:11])[N:12]2[CH2:13][c:14]3[n:15]([cH:23][cH:24][cH:25]3)[CH2:16][c:17]3[c:18]2[cH:19][cH:20][cH:21][cH:22]3)[cH:26][cH:27]1Participants
4
Sources & evidence
- ORD record
- ord-722bcf4035e0477c8a51076a9499d8bf
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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