Bicarbonate Ion → N-[5-benzyloxy-6-(3-chlorobenzylcarbamoyl)-1-(2,2-dimethoxyethyl)-4-oxo-1,4-dihydropyridin-3-yl]propionamide

HRID 2349637Notes

Reaction equation

HRID 2349637 reaction equation
[C:41]([CH2:42][CH3:43])(=[O:44])[Cl:45].[C:46](=[O:47])([O-:48])[OH:49].[CH3:34][CH2:35][N:36]([CH2:37][CH3:38])[CH2:39][CH3:40].[CH:51]([Cl:52])([Cl:53])[Cl:54].[Cl:1][c:2]1[cH:3][c:4]([CH2:5][NH:6][C:7](=[O:8])[c:9]2[n:10]([CH2:25][CH:26]([O:27][CH3:28])[O:29][CH3:30])[cH:11][c:12]([NH2:24])[c:13](=[O:23])[c:14]2[O:15][CH2:16][c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[cH:31][cH:32][cH:33]1.[Na+:50]>>[Cl:1][c:2]1[cH:3][c:4]([CH2:5][NH:6][C:7](=[O:8])[c:9]2[n:10]([CH2:25][CH:26]([O:27][CH3:28])[O:29][CH3:30])[cH:11][c:12]([NH:24][C:41]([CH2:42][CH3:43])=[O:44])[c:13](=[O:23])[c:14]2[O:15][CH2:16][c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[cH:31][cH:32][cH:33]1

Participants

7

Reactant 6

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 6212ChloroformHCID 8471TriethylamineHCID 62324Propionyl chlorideHCID 588591465-Amino-3-benzyloxy-1-(2,2-dimethoxyethyl)-4-oxo-1,4-dihydropyridine-2-carboxylic acid 3-chlorobenzylamide

Product 1

HCID 21091375N-[5-benzyloxy-6-(3-chlorobenzylcarbamoyl)-1-(2,2-dimethoxyethyl)-4-oxo-1,4-dihydropyridin-3-yl]propionamide

Sources & evidence

ORD record
ord-efd82a86ed584ccc8290d2be34ef18a4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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