p-(Methylsulphonyl)benzoic acid → HCID 71208292, compound
Reaction equation
[CH3:26][S:27](=[O:28])(=[O:29])[c:30]1[cH:31][cH:32][c:33]([C:34](=[O:35])[OH:36])[cH:37][cH:38]1.[NH2:1][CH2:2][c:3]1[c:4]([C:21](=[O:22])[N:23]([CH3:24])[CH3:25])[n:5](-[c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[c:6]2[cH:7][c:8]([Cl:14])[cH:9][cH:10][c:11]2[c:12]1=[O:13]>>[NH:1]([CH2:2][c:3]1[c:4]([C:21](=[O:22])[N:23]([CH3:24])[CH3:25])[n:5](-[c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[c:6]2[cH:7][c:8]([Cl:14])[cH:9][cH:10][c:11]2[c:12]1=[O:13])[C:34]([c:33]1[cH:32][cH:31][c:30]([S:27]([CH3:26])(=[O:28])=[O:29])[cH:38][cH:37]1)=[O:35]Participants
3
Sources & evidence
- ORD record
- ord-d21f25955da046e196d6e4311394b9e4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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