Carbonate Ion → 6-[2-(Azetidine-1-carbonyl)-thieno[3,2-b]pyridin-7-yloxy]-1,2-dimethyl-1H-indole-3-carboxylic acid (3-hydroxy-propyl)-amide

HRID 2324210Notes

Reaction equation

HRID 2324210 reaction equation
[C:36](=[O:37])([O-:38])[O-:39].[Cs+:40].[Cs+:41].[N:1]1([C:5](=[O:6])[c:7]2[cH:8][c:9]3[n:10][cH:11][cH:12][c:13]([Cl:16])[c:14]3[s:15]2)[CH2:2][CH2:3][CH2:4]1.[OH:17][CH2:18][CH2:19][CH2:20][NH:21][C:22](=[O:23])[c:24]1[c:25]([CH3:35])[n:26]([CH3:34])[c:27]2[cH:28][c:29]([OH:33])[cH:30][cH:31][c:32]12>>[N:1]1([C:5](=[O:6])[c:7]2[cH:8][c:9]3[n:10][cH:11][cH:12][c:13]([O:33][c:29]4[cH:28][c:27]5[n:26]([CH3:34])[c:25]([CH3:35])[c:24]([C:22]([NH:21][CH2:20][CH2:19][CH2:18][OH:17])=[O:23])[c:32]5[cH:31][cH:30]4)[c:14]3[s:15]2)[CH2:2][CH2:3][CH2:4]1

Participants

5

Reactant 4

HCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 207678646-Hydroxy-1,2-dimethyl-1H-indole-3-carboxylic acid (3-hydroxy-propyl)-amideHCID 221435492-(Azetidin-1-ylcarbonyl)-7-chlorothieno[3,2-b]pyridine

Product 1

HCID 207678566-[2-(Azetidine-1-carbonyl)-thieno[3,2-b]pyridin-7-yloxy]-1,2-dimethyl-1H-indole-3-carboxylic acid (3-hydroxy-propyl)-amide

Sources & evidence

ORD record
ord-06bddde9d91b4458ab760c904c7462e1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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