Benzene → HCID 59811927, compound

HRID 1127740Notes

Reaction equation

HRID 1127740 reaction equation
[Br-:38].[CH2:39]([N+:40]([CH2:41][CH2:42][CH2:43][CH3:44])([CH2:45][CH2:46][CH2:47][CH3:48])[CH2:49][CH2:50][CH2:51][CH3:52])[CH2:53][CH2:54][CH3:55].[I:1][c:2]1[cH:3][nH:4][c:5]2[n:6][cH:7][c:8](-[c:11]3[cH:12][cH:13][c:14]([N:17]([CH3:18])[CH3:19])[cH:15][cH:16]3)[cH:9][c:10]12.[Na+:31].[OH-:30].[c:20]1([S:26](=[O:27])(=[O:28])[Cl:29])[cH:21][cH:22][cH:23][cH:24][cH:25]1.[cH:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1>>[I:1][c:2]1[cH:3][n:4]([S:26]([c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)(=[O:27])=[O:28])[c:5]2[n:6][cH:7][c:8](-[c:11]3[cH:12][cH:13][c:14]([N:17]([CH3:18])[CH3:19])[cH:15][cH:16]3)[cH:9][c:10]12

Participants

8

Reactant 7

HCID 241BenzeneHCID 259Bromide ionHCID 923Sodium ionHCID 961HydroxideHCID 7369Benzenesulfonyl chlorideHCID 16028TetrabutylammoniumHCID 59811932HCID 59811932, compound

Product 1

HCID 59811927HCID 59811927, compound

Sources & evidence

ORD record
ord-40978886203340a7bbb7acd7db7add73
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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