tert-Butanol → N-(4-(4-(5-methyl-1H-pyrazol-3-ylamino)-6-phenylpyrimidin-2-ylthio)phenyl)acetamide

HRID 321050Notes

Reaction equation

HRID 321050 reaction equation
[C:21]([CH3:22])(=[O:23])[NH:24][c:25]1[cH:26][cH:27][c:28]([SH:31])[cH:29][cH:30]1.[CH3:32][C:33]([OH:34])([CH3:35])[CH3:36].[Cl:1][c:2]1[n:3][c:4](-[c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[cH:5][c:6]([NH:8][c:9]2[nH:10][n:11][c:12]([CH3:14])[cH:13]2)[n:7]1>>[c:2]1([S:31][c:28]2[cH:27][cH:26][c:25]([NH:24][C:21]([CH3:22])=[O:23])[cH:30][cH:29]2)[n:3][c:4](-[c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[cH:5][c:6]([NH:8][c:9]2[nH:10][n:11][c:12]([CH3:14])[cH:13]2)[n:7]1

Participants

4

Reactant 3

HCID 6386tert-ButanolHCID 707774'-MercaptoacetanilideHCID 178418761(2-chloro-6-phenyl-pyrimidin-4-yl)-(5-methyl-2H-pyrazol-3-yl)-amine

Product 1

HCID 178419061N-(4-(4-(5-methyl-1H-pyrazol-3-ylamino)-6-phenylpyrimidin-2-ylthio)phenyl)acetamide

Sources & evidence

ORD record
ord-7547890d690244cca3f6a42868776a31
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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