Bromide ion → 2,4,6-Trimethyl-N-[2,2,2-trifluoro-1-(4-phenyl-1H-indol-3-ylmethyl)ethyl]benzenesulfonamide

HRID 1122768

Reaction equation

HRID 1122768 reaction equation
[Br-:16].[CH2:17]([Mg+:18])[CH3:19].[CH3:39][O:40][C:41]([CH3:42])([CH3:43])[CH3:44].[Cu:45][I:46].[F:20][C:21]([CH:22]1[N:23]([S:25](=[O:26])(=[O:27])[c:28]2[c:29]([CH3:36])[cH:30][c:31]([CH3:35])[cH:32][c:33]2[CH3:34])[CH2:24]1)([F:37])[F:38].[c:1]1(-[c:7]2[c:8]3[cH:9][cH:10][nH:11][c:12]3[cH:13][cH:14][cH:15]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[c:7]2[c:8]3[c:9]([CH2:24][CH:22]([C:21]([F:20])([F:37])[F:38])[NH:23][S:25](=[O:26])(=[O:27])[c:28]4[c:29]([CH3:36])[cH:30][c:31]([CH3:35])[cH:32][c:33]4[CH3:34])[cH:10][nH:11][c:12]3[cH:13][cH:14][cH:15]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

7

Reactant 6

HCID 259Bromide ionHCID 15413tert-Butyl methyl etherHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 158062984-Phenyl-1H-indoleHCID 574740362-Trifluoromethyl-1-(2,4,6-trimethylbenzenesulfonyl)aziridineHCID 178461628HCID 178461628, compound

Product 1

HCID 116487802,4,6-Trimethyl-N-[2,2,2-trifluoro-1-(4-phenyl-1H-indol-3-ylmethyl)ethyl]benzenesulfonamide

Sources & evidence

ORD record
ord-695fa523bbc24b46a77b243cb52952fb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Linked notes

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