Water → 5-(3,5-Dimethylphenylthio)-4-isopropyl-1-[2-(1-methoxycyclopentyloxy)ethoxymethyl]-2-methyl-1H-imidazole

HRID 211892

Reaction equation

HRID 211892 reaction equation
[CH2:52]([Cl:53])[Cl:54].[CH3:1][c:2]1[cH:3][c:4]([S:9][c:10]2[c:11]([CH:21]([CH3:22])[CH3:23])[n:12][c:13]([CH3:20])[n:14]2[CH2:15][O:16][CH2:17][CH2:18][OH:19])[cH:5][c:6]([CH3:8])[cH:7]1.[CH3:36][O:37][C:38]1([O:43][CH3:44])[CH2:39][CH2:40][CH2:41][CH2:42]1.[CH3:45][CH2:46][N:47]([CH2:48][CH3:49])[CH2:50][CH3:51].[OH2:24].[c:25]1([CH3:26])[cH:27][cH:28][c:29]([S:30]([OH:31])(=[O:32])=[O:33])[cH:34][cH:35]1>>[CH3:1][c:2]1[cH:3][c:4]([S:9][c:10]2[c:11]([CH:21]([CH3:22])[CH3:23])[n:12][c:13]([CH3:20])[n:14]2[CH2:15][O:16][CH2:17][CH2:18][O:19][C:38]2([O:37][CH3:36])[CH2:39][CH2:40][CH2:41][CH2:42]2)[cH:5][c:6]([CH3:8])[cH:7]1

Participants

7

Reactant 6

HCID 962WaterHCID 6101p-Toluenesulfonic acidHCID 6344DichloromethaneHCID 8471TriethylamineHCID 4781802-[5-(3,5-Dimethyl-phenylsulfanyl)-4-isopropyl-2-methyl-imidazol-1-ylmethoxy]-ethanolHCID 5230521,1-Dimethoxy-cyclopentane

Product 1

HCID 158871845-(3,5-Dimethylphenylthio)-4-isopropyl-1-[2-(1-methoxycyclopentyloxy)ethoxymethyl]-2-methyl-1H-imidazole

Sources & evidence

ORD record
ord-c6743ec83e874fb880429e657f09e316
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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