Sodium ion → 7-benzyl-4-(2,4,6-trimethyl-phenoxy)-7H-pyrrolo[2,3-d]pyrimidin-2-ylamine

HRID 670205

Reaction equation

HRID 670205 reaction equation
[CH2:13]([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[n:20]1[cH:21][cH:22][c:23]2[c:24]1[n:25][c:26]([NH2:30])[n:27][c:28]2[Cl:29].[CH3:1][c:2]1[c:3]([OH:10])[c:4]([CH3:9])[cH:5][c:6]([CH3:8])[cH:7]1.[CH3:32][n:33]1[cH:34][cH:35][cH:36][cH:37][c:38]1=[O:39].[H-:12].[Na+:11].[OH2:31]>>[CH3:1][c:2]1[c:3]([O:10][c:28]2[c:23]3[cH:22][cH:21][n:20]([CH2:13][c:14]4[cH:15][cH:16][cH:17][cH:18][cH:19]4)[c:24]3[n:25][c:26]([NH2:30])[n:27]2)[c:4]([CH3:9])[cH:5][c:6]([CH3:8])[cH:7]1

Participants

7

Reactant 6

HCID 923Sodium ionHCID 962WaterHCID 106982,4,6-TrimethylphenolHCID 127551-Methyl-2(1H)-pyridinoneHCID 166653HydrideHCID 105873407-benzyl-4-chloro-7H-pyrrolo[2,3-d]pyrimidin-2-amine

Product 1

HCID 576935647-benzyl-4-(2,4,6-trimethyl-phenoxy)-7H-pyrrolo[2,3-d]pyrimidin-2-ylamine

Sources & evidence

ORD record
ord-a8c810d502b8435394c245aef4d41030
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Linked notes

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