Sodium ion → 1H-Indole, 3-(5-bromo-2-chloro-4-pyrimidinyl)-1-[(4-methylphenyl)sulfonyl]-

HRID 684618Notes

Reaction equation

HRID 684618 reaction equation
[Br:1][c:2]1[c:3](-[c:9]2[cH:10][nH:11][c:12]3[cH:13][cH:14][cH:15][cH:16][c:17]23)[n:4][c:5]([Cl:8])[n:6][cH:7]1.[CH2:32]1[O:33][CH2:34][CH2:35][CH2:36]1.[CH3:20][c:21]1[cH:22][cH:23][c:24]([S:27](=[O:28])(=[O:29])[Cl:30])[cH:25][cH:26]1.[H-:18].[Na+:19].[O:37]=[CH:38][N:39]([CH3:40])[CH3:41].[OH2:31]>>[Br:1][c:2]1[c:3](-[c:9]2[cH:10][n:11]([S:27]([c:24]3[cH:23][cH:22][c:21]([CH3:20])[cH:26][cH:25]3)(=[O:28])=[O:29])[c:12]3[cH:13][cH:14][cH:15][cH:16][c:17]23)[n:4][c:5]([Cl:8])[n:6][cH:7]1

Participants

8

Reactant 7

HCID 923Sodium ionHCID 962WaterHCID 6228DimethylformamideHCID 73974-Toluenesulfonyl chlorideHCID 8028TetrahydrofuranHCID 166653HydrideHCID 58071504HCID 58071504, compound

Product 1

HCID 580715031H-Indole, 3-(5-bromo-2-chloro-4-pyrimidinyl)-1-[(4-methylphenyl)sulfonyl]-

Sources & evidence

ORD record
ord-72f49de28ca441f09e6fb5ab6680b1a3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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