Water → 3-(2-Bromo-pyridin-4-yloxy)-N-m-tolyl-benzamide

HRID 1129658Notes

Reaction equation

HRID 1129658 reaction equation
[Br:1][c:2]1[n:3][cH:4][cH:5][c:6]([O:8][c:9]2[cH:10][c:11]([C:12](=[O:13])[OH:14])[cH:15][cH:16][cH:17]2)[cH:7]1.[CH:50]([N:51]([CH2:52][CH3:53])[CH:54]([CH3:55])[CH3:56])([CH3:57])[CH3:58].[NH2:42][c:43]1[cH:44][c:45]([CH3:49])[cH:46][cH:47][cH:48]1.[O:59]=[CH:60][N:61]([CH3:62])[CH3:63].[OH2:64].[P-:18]([F:19])([F:20])([F:21])([F:22])([F:23])[F:24].[n:25]1([O:26][C:27]([N:28]([CH3:29])[CH3:30])=[N+:31]([CH3:32])[CH3:33])[c:34]2[n:35][cH:36][cH:37][cH:38][c:39]2[n:40][n:41]1>>[Br:1][c:2]1[n:3][cH:4][cH:5][c:6]([O:8][c:9]2[cH:10][c:11]([C:12](=[O:14])[NH:42][c:43]3[cH:44][c:45]([CH3:49])[cH:46][cH:47][cH:48]3)[cH:15][cH:16][cH:17]2)[cH:7]1

Participants

8

Reactant 7

HCID 962WaterHCID 6228DimethylformamideHCID 7934m-ToluidineHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 581679363-(2-Bromo-pyridin-4-yloxy)-benzoic acid

Product 1

HCID 581679193-(2-Bromo-pyridin-4-yloxy)-N-m-tolyl-benzamide

Sources & evidence

ORD record
ord-eddb9194363c43fdb464d02a4da0c3c3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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