Tetrahydrofuran → 3-bromo-2-phenyl-9H-imidazo[1,2-d]pyrido[2,3-b][1,4]benzodiazepine

반응식

[Br:25][N:26]1[C:27](=[O:28])[CH2:29][CH2:30][C:31]1=[O:32].[CH2:33]1[O:34][CH2:35][CH2:36][CH2:37]1.[c:1]1(-[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:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[c:7]2[n:8][c:9]3[n:10]([c:24]2[Br:25])-[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:2][cH:3][cH:4][cH:5][cH:6]1

참가 물질

반응물 3

HCID 8028Tetrahydrofuran

HCID 67184N-bromobutanimide

HCID 1363902582-phenyl-9H-benzo[f]imidazo[1,2-d]pyrido[2,3-b][1,4]diazepine

생성물 1

HCID 675030133-bromo-2-phenyl-9H-imidazo[1,2-d]pyrido[2,3-b][1,4]benzodiazepine

출처 및 근거

ORD 기록: ord-5583a91c02dd411d8929c55037ad1c40
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

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