Acetic Acid → 2-Bromo-1-[7-(toluene-4-sulfonyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-ethanone

반응식

[Br:24].[BrH:23].[CH3:25][C:26](=[O:27])[OH:28].[c:1]1([CH3:22])[cH:2][cH:3][c:4]([S:7](=[O:8])(=[O:9])[n:10]2[cH:11][cH:12][c:13]3[c:14]2[n:15][cH:16][n:17][c:18]3[C:19]([CH3:20])=[O:21])[cH:5][cH:6]1>>[c:1]1([CH3:22])[cH:2][cH:3][c:4]([S:7](=[O:8])(=[O:9])[n:10]2[cH:11][cH:12][c:13]3[c:14]2[n:15][cH:16][n:17][c:18]3[C:19]([CH2:20][Br:23])=[O:21])[cH:5][cH:6]1

참가 물질

반응물 3

HCID 176Acetic Acid

HCID 260Hydrogen Bromide2회

HCID 586917071-(7-Tosyl-7H-pyrrolo[2,3-D]pyrimidin-4-YL)ethan-1-one

생성물 1

HCID 586917252-Bromo-1-[7-(toluene-4-sulfonyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-ethanone

출처 및 근거

ORD 기록: ord-3220fd28ccc141328c2d73b6c309de08
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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