Water → 2,2-Dimethylpropionic acid 4-[3-(4-fluorophenyl)-1,9-dimethyl-2-oxo-2,9-dihydro-1H-pyrido[2,3-b]indol-6-yl]-thiazol-2-ylmethyl ester

HRID 1204473Notes

Reaction equation

HRID 1204473 reaction equation
[C:31]([C:32]([CH3:33])([CH3:34])[CH3:35])(=[O:36])[Cl:37].[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][c:10]3[c:11]([n:12]([CH3:26])[c:13]4[cH:14][cH:15][c:16](-[c:19]5[n:20][c:21]([CH2:24][OH:25])[s:22][cH:23]5)[cH:17][c:18]34)[n:27]([CH3:30])[c:28]2=[O:29])[cH:6][cH:7]1.[OH2:38].[cH:39]1[cH:40][cH:41][n:42][cH:43][cH:44]1>>[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][c:10]3[c:11]([n:12]([CH3:26])[c:13]4[cH:14][cH:15][c:16](-[c:19]5[n:20][c:21]([CH2:24][O:25][C:31]([C:32]([CH3:33])([CH3:34])[CH3:35])=[O:36])[s:22][cH:23]5)[cH:17][c:18]34)[n:27]([CH3:30])[c:28]2=[O:29])[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 962WaterHCID 1049PyridineHCID 62493Pivaloyl chlorideHCID 669982663-(4-Fluorophenyl)-6-(2-hydroxymethylthiazol-4-yl)-1,9-dimethyl-1,9-dihydropyrido[2,3-b]indol-2-one

Product 1

HCID 669978782,2-Dimethylpropionic acid 4-[3-(4-fluorophenyl)-1,9-dimethyl-2-oxo-2,9-dihydro-1H-pyrido[2,3-b]indol-6-yl]-thiazol-2-ylmethyl ester

Sources & evidence

ORD record
ord-45381825f50e457290b63187e327ac3c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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