Methyl 4-(bromomethyl)benzoate → HCID 58614817, compound
Reaction equation
[Br:1][CH2:2][c:3]1[cH:4][cH:5][c:6]([C:7]([O:8][CH3:9])=[O:10])[cH:11][cH:12]1.[CH3:13][S:14](=[O:15])(=[O:16])[CH2:17][c:18]1[cH:19][cH:20][c:21]([C:22]([O:24][CH3:23])=[O:25])[cH:26][cH:27]1.[CH3:42][S:43]([CH2:44][c:45]1[cH:46][cH:47][c:48]([C:49]([OH:50])=[O:51])[cH:52][cH:53]1)(=[O:54])=[O:55].[Cl:28][c:29]1[c:30](-[c:36]2[n:37][cH:38][cH:39][cH:40][cH:41]2)[cH:31][c:32]([NH2:33])[cH:34][cH:35]1>>[CH3:13][S:14](=[O:15])(=[O:16])[CH2:17][c:18]1[cH:19][cH:20][c:21]([C:22](=[O:24])[NH:33][c:32]2[cH:31][c:30](-[c:36]3[n:37][cH:38][cH:39][cH:40][cH:41]3)[c:29]([Cl:28])[cH:35][cH:34]2)[cH:26][cH:27]1Participants
5
Sources & evidence
- ORD record
- ord-ea3c3c344ab944a09491fa8f6de608a4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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