3-Azido-4-methylbenzoic acid → 3-Azido-N-(5-tert-butyl-3-cyano-2-methoxy-phenyl)-4-methyl-benzamide
Reaction equation
[N:1](=[N+:2]=[N-:3])[c:4]1[cH:5][c:6]([C:7](=[O:8])[OH:9])[cH:10][cH:11][c:12]1[CH3:13].[N:29]([c:30]1[cH:31][c:32]([C:37]([NH:38][c:39]2[cH:40][c:41]([C:42]([CH3:43])([CH3:44])[CH3:45])[cH:46][c:47]([NH:48][S:49]([CH3:50])(=[O:51])=[O:52])[c:53]2[O:54][CH3:55])=[O:56])[cH:33][cH:34][c:35]1[CH3:36])=[N+:57]=[N-:58].[NH2:14][c:15]1[c:16]([O:27][CH3:28])[c:17]([C:18]#[N:19])[cH:20][c:21]([C:23]([CH3:24])([CH3:25])[CH3:26])[cH:22]1>>[N:1](=[N+:2]=[N-:3])[c:4]1[cH:5][c:6]([C:7](=[O:9])[NH:14][c:15]2[c:16]([O:27][CH3:28])[c:17]([C:18]#[N:19])[cH:20][c:21]([C:23]([CH3:24])([CH3:25])[CH3:26])[cH:22]2)[cH:10][cH:11][c:12]1[CH3:13]Participants
4
Sources & evidence
- ORD record
- ord-c685afa9b5144310b4afc5a18e9b709d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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