Carbonate Ion → 1,2-Dimethyl-6-[2-(1-methyl-1H-imidazol-2-yl)-thieno[3,2-b]pyridin-7-yloxy]-1H-indole-3-carboxylic acid cyclopropylamide

HRID 676995Notes

Reaction equation

HRID 676995 reaction equation
[C:35](=[O:36])([O-:37])[O-:38].[CH:17]1([NH:20][C:21](=[O:22])[c:23]2[c:24]([CH3:34])[n:25]([CH3:33])[c:26]3[cH:27][c:28]([OH:32])[cH:29][cH:30][c:31]23)[CH2:18][CH2:19]1.[Cl:1][c:2]1[c:3]2[c:4]([n:5][cH:6][cH:7]1)[cH:8][c:9](-[c:11]1[n:12]([CH3:16])[cH:13][cH:14][n:15]1)[s:10]2.[Cs+:39].[Cs+:40]>>[c:2]1([O:32][c:28]2[cH:27][c:26]3[n:25]([CH3:33])[c:24]([CH3:34])[c:23]([C:21]([NH:20][CH:17]4[CH2:18][CH2:19]4)=[O:22])[c:31]3[cH:30][cH:29]2)[c:3]2[c:4]([n:5][cH:6][cH:7]1)[cH:8][c:9](-[c:11]1[n:12]([CH3:16])[cH:13][cH:14][n:15]1)[s:10]2

Participants

5

Reactant 4

HCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 221435471,2-dimethyl-6-hydroxy-1H-indole-3-carboxylic acid cyclopropylamideHCID 221435637-chloro-2-(1-methyl-1H-imidazol-2-yl)-thieno[3,2-b]pyridine

Product 1

HCID 100956321,2-Dimethyl-6-[2-(1-methyl-1H-imidazol-2-yl)-thieno[3,2-b]pyridin-7-yloxy]-1H-indole-3-carboxylic acid cyclopropylamide

Sources & evidence

ORD record
ord-2f08e16fe20a43058d4018d57e416f42
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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