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Trimethylaluminum → rac-(4S*,5R*)-5-[4,5-Bis-(4-chlorophenyl)-4,5-dimethyl-4,5-dihydro-1H-imidazol-2-yl]-N-tert-butyl-2-chloro-4-ethoxybenzenesulfonamide

HRID 2330694
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HRID 2330694 반응식
[CH3:35][O:36][C:37]([c:38]1[c:39]([O:53][CH2:54][CH3:55])[cH:40][c:41]([Cl:52])[c:42]([S:44]([NH:45][C:46]([CH3:47])([CH3:48])[CH3:49])(=[O:50])=[O:51])[cH:43]1)=[O:56].[CH3:57][Al:58]([CH3:59])[CH3:60].[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]2([CH3:34])[N:9]=[C:10]([c:21]3[cH:22][cH:23][c:24]([C:25]([CH3:26])([CH3:27])[CH3:28])[cH:29][c:30]3[O:31][CH2:32][CH3:33])[NH:11][C:12]2([CH3:13])[c:14]2[cH:15][cH:16][c:17]([Cl:20])[cH:18][cH:19]2)[cH:6][cH:7]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]2([CH3:34])[N:9]=[C:37]([c:38]3[c:39]([O:53][CH2:54][CH3:55])[cH:40][c:41]([Cl:52])[c:42]([S:44]([NH:45][C:46]([CH3:47])([CH3:48])[CH3:49])(=[O:50])=[O:51])[cH:43]3)[NH:11][C:12]2([CH3:13])[c:14]2[cH:15][cH:16][c:17]([Cl:20])[cH:18][cH:19]2)[cH:6][cH:7]1
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참가 물질

4

반응물 3

HCID 16682925TrimethylaluminumHCID 53628801rac-(4S*,5R*)-2-(4-tert-butyl-2-ethoxy-phenyl)-4,5-bis-(4-chloro-phenyl)-4,5-dimethyl-4,5-dihydro-1H-imidazoleHCID 588942525-Tert-butylsulfamoyl-4-chloro-2-ethoxybenzoic acid methyl ester

생성물 1

HCID 68683983rac-(4S*,5R*)-5-[4,5-Bis-(4-chlorophenyl)-4,5-dimethyl-4,5-dihydro-1H-imidazol-2-yl]-N-tert-butyl-2-chloro-4-ethoxybenzenesulfonamide

출처 및 근거

ORD 기록
ord-dca0c233b9694e2a9adad97e1196022b
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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