4-Hydroxymethylpyridine → 6-bromo-2-(4-methanesulfonylbenzyl)-1-oxo-4-phenyl-1,2-dihydroisoquinoline-3-carboxylic Acid pyridin-4-ylmethyl Ester

반응식

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

참가 물질

반응물 2

HCID 114724-Hydroxymethylpyridine

HCID 230609586-Bromo-2-(4-methanesulfonylbenzyl)-1-oxo-4-phenyl-1,2-dihydroisoquinoline-3-carboxylic acid

생성물 1

HCID 691569506-bromo-2-(4-methanesulfonylbenzyl)-1-oxo-4-phenyl-1,2-dihydroisoquinoline-3-carboxylic Acid pyridin-4-ylmethyl Ester

출처 및 근거

ORD 기록: ord-f57911fb0afb4a58817496274dd704be
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

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