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Acetate → 2-[[3-Methyl-1-(2-pyridinyl)-1H-pyrazol-5-yl]amino]benzoic acid

HRID 176100
Notes
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Reaction equation

HRID 176100 reaction equation
[C:24](=[O:25])([O-:26])[O-:27].[C:36]([O-:37])(=[O:38])[CH3:39].[C:41]([O-:42])(=[O:43])[CH3:44].[CH3:1][c:2]1[n:3][n:4](-[c:8]2[n:9][cH:10][cH:11][cH:12][cH:13]2)[c:5]([NH2:7])[cH:6]1.[CH3:31][N:32]([CH3:33])[CH:34]=[O:35].[CH3:45][C:46](=[O:47])[OH:48].[Cu+2:40].[I:14][c:15]1[c:16]([C:17](=[O:18])[OH:19])[cH:20][cH:21][cH:22][cH:23]1.[K+:28].[K+:29].[OH2:30]>>[CH3:1][c:2]1[n:3][n:4](-[c:8]2[n:9][cH:10][cH:11][cH:12][cH:13]2)[c:5]([NH:7][c:15]2[c:16]([C:17](=[O:18])[OH:19])[cH:20][cH:21][cH:22][cH:23]2)[cH:6]1
ParticipantsSources & evidenceReaction notes

Participants

10

Reactant 9

HCID 175Acetate2×HCID 176Acetic AcidHCID 813Potassium Cation2×HCID 962WaterHCID 6228DimethylformamideHCID 69412-Iodobenzoic acidHCID 19660Carbonate Ion
HCID 27099
Cupric cation
HCID 7351323-Methyl-1-(pyridin-2-yl)-1H-pyrazol-5-amine

Product 1

HCID 223201402-[[3-Methyl-1-(2-pyridinyl)-1H-pyrazol-5-yl]amino]benzoic acid

Sources & evidence

ORD record
ord-d17d376de1b347d2a078b7da34824627
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes