Phosgene → rac-(4S,5R)-2-(4-tert-Butyl-2-ethoxy-phenyl)-4,5-bis-(4-chloro-phenyl)-4-methyl-4,5-dihydro-imidazole-1-carbonyl chloride

반응식

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

참가 물질

반응물 3

HCID 6371Phosgene

HCID 8471Triethylamine

HCID 178466263HCID 178466263, 화합물

생성물 1

HCID 72455720rac-(4S*,5R*)-2-(4-tert-Butyl-2-ethoxy-phenyl)-4,5-bis-(4-chloro-phenyl)-4-methyl-4,5-dihydro-imidazole-1-carbonyl chloride

출처 및 근거

ORD 기록: ord-9f73defbed72415e84c26110dc4a8011
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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