Dichloromethane → 3-(3,5-Dichloro-phenyl)-1-[4-(4-iodo-phenyl)-piperidin-4-ylmethyl]-1-methyl-urea

반응식

[C:1]([O:2][C:3](=[O:4])[N:8]1[CH2:9][CH2:10][C:11]([c:14]2[cH:15][cH:16][c:17]([I:20])[cH:18][cH:19]2)([CH2:21][N:22]([C:23](=[O:24])[NH:25][c:26]2[cH:27][c:28]([Cl:33])[cH:29][c:30]([Cl:32])[cH:31]2)[CH3:34])[CH2:12][CH2:13]1)([CH3:5])([CH3:6])[CH3:7].[Cl:42][CH2:43][Cl:44].[F:35][C:36]([F:37])([F:38])[C:39]([OH:40])=[O:41]>>[NH:8]1[CH2:9][CH2:10][C:11]([c:14]2[cH:15][cH:16][c:17]([I:20])[cH:18][cH:19]2)([CH2:21][N:22]([C:23](=[O:24])[NH:25][c:26]2[cH:27][c:28]([Cl:33])[cH:29][c:30]([Cl:32])[cH:31]2)[CH3:34])[CH2:12][CH2:13]1

참가 물질

반응물 3

HCID 6344Dichloromethane

HCID 6422Trifluoroacetic acid

HCID 68534877HCID 68534877, 화합물

생성물 1

HCID 224903673-(3,5-Dichloro-phenyl)-1-[4-(4-iodo-phenyl)-piperidin-4-ylmethyl]-1-methyl-urea

출처 및 근거

ORD 기록: ord-3c444ef263f541cdbc18ab05b5965739
출처 데이터셋: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D

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