4-Toluenesulfonyl chloride → [3-(2-{[Ethyl-(toluene-4-sulfonyl)-amino]-methyl}-4-trifluoromethyl-phenoxy)-phenyl]-acetic acid methyl ester

HRID 2332886Notes

Reaction equation

HRID 2332886 reaction equation
[CH3:1][O:2][C:3]([CH2:4][c:5]1[cH:6][c:7]([O:11][c:12]2[c:13]([CH2:22][NH:23][CH2:24][CH3:25])[cH:14][c:15]([C:18]([F:19])([F:20])[F:21])[cH:16][cH:17]2)[cH:8][cH:9][cH:10]1)=[O:26].[c:27]1([CH3:37])[cH:28][cH:29][c:30]([S:33](=[O:34])(=[O:35])[Cl:36])[cH:31][cH:32]1>>[CH3:1][O:2][C:3]([CH2:4][c:5]1[cH:6][c:7]([O:11][c:12]2[c:13]([CH2:22][N:23]([CH2:24][CH3:25])[S:33]([c:30]3[cH:29][cH:28][c:27]([CH3:37])[cH:32][cH:31]3)(=[O:34])=[O:35])[cH:14][c:15]([C:18]([F:19])([F:20])[F:21])[cH:16][cH:17]2)[cH:8][cH:9][cH:10]1)=[O:26]

Participants

3

Reactant 2

HCID 73974-Toluenesulfonyl chlorideHCID 58288538[3-(2-Ethylaminomethyl-4-trifluoromethyl-phenoxy)-phenyl]-acetic acid methyl ester

Product 1

HCID 58288464[3-(2-{[Ethyl-(toluene-4-sulfonyl)-amino]-methyl}-4-trifluoromethyl-phenoxy)-phenyl]-acetic acid methyl ester

Sources & evidence

ORD record
ord-5efb7138212843ee947a712e67427f82
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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