Thiophenol → HCID 57477895, compound

HRID 692475Notes

Reaction equation

HRID 692475 reaction equation
[Br:1][c:2]1[cH:3][c:4]([CH:8]([CH2:9][C:10]#[N:11])[n:12]2[n:13][cH:14][c:15](-[c:17]3[c:18]4[c:19]([n:20][cH:21][n:22]3)[n:23]([CH2:26][O:27][CH2:28][CH2:29][Si:30]([CH3:31])([CH3:32])[CH3:33])[cH:24][cH:25]4)[cH:16]2)[cH:5][n:6][cH:7]1.[CH2:34]1[O:35][CH2:36][CH2:37][O:38][CH2:39]1.[CH:40]([N:41]([CH2:42][CH3:43])[CH:44]([CH3:45])[CH3:46])([CH3:47])[CH3:48].[SH:49][c:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1>>[c:2]1([S:49][c:50]2[cH:51][cH:52][cH:53][cH:54][cH:55]2)[cH:3][c:4]([CH:8]([CH2:9][C:10]#[N:11])[n:12]2[n:13][cH:14][c:15](-[c:17]3[c:18]4[c:19]([n:20][cH:21][n:22]3)[n:23]([CH2:26][O:27][CH2:28][CH2:29][Si:30]([CH3:31])([CH3:32])[CH3:33])[cH:24][cH:25]4)[cH:16]2)[cH:5][n:6][cH:7]1

Participants

5

Reactant 4

HCID 7969ThiophenolHCID 312751,4-DioxaneHCID 81531DiisopropylethylamineHCID 574778813-(5-bromopyridin-3-yl)-3-[4-(7-[2-(trimethylsilyl)ethoxy]methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl]propanenitrile

Product 1

HCID 57477895HCID 57477895, compound

Sources & evidence

ORD record
ord-28774bed72454f56a41c983e32193b89
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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