3-Benzylamino-5-nitro-4-phenylbenzoic acid → 5-Amino-4-phenyl-3-(2-pyridylmethylthio)-benzoic acid
Reaction equation
[CH2:1]([NH:2][c:3]1[cH:4][c:5]([C:18]([OH:19])=[O:20])[cH:6][c:7]([N+:8]([O-:9])=[O:10])[c:11]1-[c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1)[c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1.[N+:27]([O-:28])(=[O:29])[c:30]1[c:31](-[c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)[c:32]([S:39][CH2:40][c:41]2[n:42][cH:43][cH:44][cH:45][cH:46]2)[cH:33][c:34]([C:35](=[O:36])[OH:37])[cH:38]1>>[NH2:27][c:30]1[c:31](-[c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)[c:32]([S:39][CH2:40][c:41]2[n:42][cH:43][cH:44][cH:45][cH:46]2)[cH:33][c:34]([C:35](=[O:36])[OH:37])[cH:38]1Participants
3
Sources & evidence
- ORD record
- ord-86adec92217b4c9699f17755b314eba8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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