Dichloromethane → N-Trifluoroacetyl-7-(4-bromo-2-Methyl-2H-pyrazol-3-yl)-1-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine

반응식

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

참가 물질

반응물 3

HCID 6344Dichloromethane

HCID 67184N-bromobutanimide

HCID 22292810N-Trifluoroacetyl-7-(2-Methyl-2H-pyrazol-3-yl)-1-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine

생성물 1

HCID 22292801N-Trifluoroacetyl-7-(4-bromo-2-Methyl-2H-pyrazol-3-yl)-1-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine

출처 및 근거

ORD 기록: ord-013a087615b047ec8cf5ec69a227eb72
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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