3,5-Dimethyl-4-hydroxybenzonitrile → 4-{2-[2-(4-Chloro-phenyl)-5,6-difluoro-benzoimidazol-1-yl]-2-cyclopropyl-ethoxy}-3,5-dimethyl-benzonitrile

HRID 1209266Notes

Reaction equation

HRID 1209266 reaction equation
[CH3:25][c:26]1[cH:27][c:28]([C:29]#[N:30])[cH:31][c:32]([CH3:35])[c:33]1[OH:34].[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][c:10]3[c:11]([n:12]2[CH:13]([CH2:14][OH:15])[CH:16]2[CH2:17][CH2:18]2)[cH:19][c:20]([F:24])[c:21]([F:23])[cH:22]3)[cH:6][cH:7]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][c:10]3[c:11]([n:12]2[CH:13]([CH2:14][O:15][c:33]2[c:26]([CH3:25])[cH:27][c:28]([C:29]#[N:30])[cH:31][c:32]2[CH3:35])[CH:16]2[CH2:17][CH2:18]2)[cH:19][c:20]([F:24])[c:21]([F:23])[cH:22]3)[cH:6][cH:7]1

Participants

3

Reactant 2

HCID 201763,5-Dimethyl-4-hydroxybenzonitrileHCID 666194522-[2-(4-Chloro-phenyl)-5,6-difluoro-benzoimidazol-1-yl]-2-cyclopropyl-ethanol

Product 1

HCID 666192504-{2-[2-(4-Chloro-phenyl)-5,6-difluoro-benzoimidazol-1-yl]-2-cyclopropyl-ethoxy}-3,5-dimethyl-benzonitrile

Sources & evidence

ORD record
ord-2ef9c5ab98ea4c00b69f7490e4b0fcaf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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