Toluene → HCID 53871517, compound
Reaction equation
[Br:26][CH2:27][CH2:28][CH2:29][C:30](=[O:31])[O:32][CH2:33][CH3:34].[CH3:1][c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1.[CH3:35][CH2:36][N:37]([CH2:38][CH3:39])[CH2:40][CH3:41].[NH2:8][c:9]1[cH:10][c:11]([CH:12]=[CH:13][c:14]2[s:15][c:16]3[c:17]([n:18]2)[cH:19][cH:20][cH:21][cH:22]3)[cH:23][cH:24][cH:25]1>>[NH:8]([c:9]1[cH:10][c:11]([CH:12]=[CH:13][c:14]2[s:15][c:16]3[c:17]([n:18]2)[cH:19][cH:20][cH:21][cH:22]3)[cH:23][cH:24][cH:25]1)[CH2:27][CH2:28][CH2:29][C:30](=[O:31])[O:32][CH2:33][CH3:34]Participants
5
Sources & evidence
- ORD record
- ord-5d1081b0bbe14aecaf8d0788bb7505fb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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