4-Bromothiophene-3-carbonitrile → 4-(4-Hydroxyphenyl)thiophene-3-carbonitrile

HRID 1201832Notes

Reaction equation

HRID 1201832 reaction equation
[Br:60][c:61]1[c:62]([C:66]#[N:67])[cH:63][s:64][cH:65]1.[CH3:68][C:69]1([CH3:70])[C:71]([CH3:72])([CH3:73])[O:74][B:75]([c:76]2[cH:77][cH:78][c:79]([OH:82])[cH:80][cH:81]2)[O:83]1.[OH:49][CH2:50][c:51]1[cH:52][cH:53][c:54]([B:55]([OH:56])[OH:57])[cH:58][cH:59]1.[s:1]1[c:2]2[cH:3][cH:4][cH:5][cH:6][c:7]2[n:8][c:9]1[N:10]([CH2:11][O:12][CH2:13][CH2:14][Si:15]([CH3:16])([CH3:17])[CH3:18])[C:19]([c:20]1[cH:21][cH:22][cH:23][c:24]2[c:25]1[CH2:26][N:27]([c:28]1[s:29][c:30](-[c:31]3[cH:32][cH:33][c:34]([CH2:35][OH:36])[cH:37][cH:38]3)[c:39]([C:40]([O:41][CH2:42][CH3:43])=[O:44])[n:45]1)[CH2:46][CH2:47]2)=[O:48]>>[c:61]1(-[c:76]2[cH:77][cH:78][c:79]([OH:82])[cH:80][cH:81]2)[c:62]([C:66]#[N:67])[cH:63][s:64][cH:65]1

Participants

5

Reactant 4

HCID 9013754-Bromothiophene-3-carbonitrileHCID 27346244-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenolHCID 27347064-(Hydroxymethyl)benzeneboronic acidHCID 59447480ethyl 2-(8-(benzo[d]thiazol-2-yl((2-(trimethylsilyl)ethoxy)methyl)carbamoyl)-3,4-dihydroisoquinolin-2(1H)-yl)-5-(4-(hydroxymethyl)phenyl)thiazole-4-carboxylate

Product 1

HCID 594475724-(4-Hydroxyphenyl)thiophene-3-carbonitrile

Sources & evidence

ORD record
ord-7ed7b2b8aa9041ce87d9335b4867a8aa
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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