Dichloromethane → [2-(4-acetamido-phenyl-sulfanyl)-6-(4-hydroxyphenyl)-pyrimidin-4-yl]-(5-methyl-2H-pyrazol-3-yl)-amine

HRID 2147033Notes

Reaction equation

HRID 2147033 reaction equation
[B:33]([Br:34])([Br:35])[Br:36].[C:1]([CH3:2])(=[O:3])[NH:4][c:5]1[cH:6][cH:7][c:8]([S:11][c:12]2[n:13][c:14](-[c:25]3[cH:26][cH:27][c:28]([O:31][CH3:32])[cH:29][cH:30]3)[cH:15][c:16]([NH:18][c:19]3[nH:20][n:21][c:22]([CH3:24])[cH:23]3)[n:17]2)[cH:9][cH:10]1.[Cl:37][CH2:38][Cl:39].[Cl:40][CH:41]([Cl:42])[CH3:43]>>[C:1]([CH3:2])(=[O:3])[NH:4][c:5]1[cH:6][cH:7][c:8]([S:11][c:12]2[n:13][c:14](-[c:25]3[cH:26][cH:27][c:28]([OH:31])[cH:29][cH:30]3)[cH:15][c:16]([NH:18][c:19]3[nH:20][n:21][c:22]([CH3:24])[cH:23]3)[n:17]2)[cH:9][cH:10]1

Participants

5

Reactant 4

HCID 6344DichloromethaneHCID 63651,1-DichloroethaneHCID 25134Boron tribromideHCID 178418826HCID 178418826, compound

Product 1

HCID 178418864[2-(4-acetamido-phenyl-sulfanyl)-6-(4-hydroxyphenyl)-pyrimidin-4-yl]-(5-methyl-2H-pyrazol-3-yl)-amine

Sources & evidence

ORD record
ord-48ffd465727f40e18f448b1f7ee05fa7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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