Tetrahydrofuran → 3-bromo-2-(o-tolyl)-9H-benzo[f]imidazo[1,2-d]pyrido[2,3-b][1,4]diazepine

반응식

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

참가 물질

반응물 3

HCID 8028Tetrahydrofuran

HCID 67184N-bromobutanimide

HCID 1363903822-(o-tolyl)-9H-benzo[f]imidazo[1,2-d]pyrido[2,3-b][1,4]diazepine

생성물 1

HCID 675042963-bromo-2-(o-tolyl)-9H-benzo[f]imidazo[1,2-d]pyrido[2,3-b][1,4]diazepine

출처 및 근거

ORD 기록: ord-c0b23d6e29924c72bc2b309cb9f20b14
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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