Acetonitrile → 5-Benzyl-4-iodo-2-(4-isopropyl-phenyl)-7-methoxy-1-(2-methoxy-ethyl)-1H-benzoimidazole

반응식

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

참가 물질

반응물 3

HCID 6342Acetonitrile

HCID 120273N-Iodosuccinimide

HCID 577720445-benzyl-2-(4-isopropyl-phenyl)-7-methoxy-1-(2-methoxy-ethyl)-1H-benzoimidazole

생성물 1

HCID 113532215-Benzyl-4-iodo-2-(4-isopropyl-phenyl)-7-methoxy-1-(2-methoxy-ethyl)-1H-benzoimidazole

출처 및 근거

ORD 기록: ord-ed8326def072427aa486ea648e42cc87
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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