Acetic Acid → N-(2-(6-(5-bromo-1-methyl-2-oxo-1,2-dihydropyridin-3-ylamino)pyridin-3-yl)propan-2-yl)acetamide

HRID 1152238Notes

Reaction equation

[Br:1][c:2]1[cH:3][c:4]([NH:10][c:11]2[n:12][cH:13][c:14]([C:17]([CH3:18])([CH3:19])[OH:20])[cH:15][cH:16]2)[c:5](=[O:9])[n:6]([CH3:8])[cH:7]1.[C:30](=[O:31])([OH:32])[O-:33].[CH3:21][C:22]([OH:23])=[O:24].[CH3:35][C:36]#[N:37].[CH3:38][CH2:39][O:40][C:41](=[O:42])[CH3:43].[Na+:34].[S:25](=[O:26])(=[O:27])([OH:28])[OH:29]>>[Br:1][c:2]1[cH:3][c:4]([NH:10][c:11]2[n:12][cH:13][c:14]([C:17]([CH3:18])([CH3:19])[NH:37][C:22]([CH3:21])=[O:24])[cH:15][cH:16]2)[c:5](=[O:9])[n:6]([CH3:8])[cH:7]1

Participants

Reactant 7

HCID 176Acetic Acid

HCID 769Bicarbonate Ion

HCID 923Sodium ion

HCID 1118Sulfuric Acid

HCID 6342Acetonitrile

HCID 8857Ethyl Acetate

HCID 594737935-Bromo-3-[5-(1-hydroxy-1-methyl-ethyl)-pyridin-2-ylamino]-1-methyl-1H-pyridin-2-one

Product 1

HCID 59473804N-(2-(6-(5-bromo-1-methyl-2-oxo-1,2-dihydropyridin-3-ylamino)pyridin-3-yl)propan-2-yl)acetamide

Sources & evidence

ORD record: ord-b003a36309a4405f85cbca34cf69b68b
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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