(Bis(2-methoxyethyl)amino)sulfur trifluoride → N-[(1RS,2SR)-2-(3-Fluoro-pyrrolidin-1-yl)-cyclopentyl]-2-methoxy-6-methylsulfanyl-4-trifluoromethyl-benzamide

HRID 91170Notes

Reaction equation

HRID 91170 reaction equation
[CH3:29][O:30][CH2:31][CH2:32][N:33]([S:34]([F:35])([F:36])[F:39])[CH2:37][CH2:38][O:40][CH3:41].[OH:1][CH:2]1[CH2:3][N:4]([CH:7]2[CH:8]([NH:12][C:13]([c:14]3[c:15]([O:26][CH3:27])[cH:16][c:17]([C:22]([F:23])([F:24])[F:25])[cH:18][c:19]3[S:20][CH3:21])=[O:28])[CH2:9][CH2:10][CH2:11]2)[CH2:5][CH2:6]1>>[CH:2]1([F:39])[CH2:3][N:4]([CH:7]2[CH:8]([NH:12][C:13]([c:14]3[c:15]([O:26][CH3:27])[cH:16][c:17]([C:22]([F:23])([F:24])[F:25])[cH:18][c:19]3[S:20][CH3:21])=[O:28])[CH2:9][CH2:10][CH2:11]2)[CH2:5][CH2:6]1

Participants

3

Reactant 2

HCID 2734690(Bis(2-methoxyethyl)amino)sulfur trifluorideHCID 66682712N-[(1RS,2SR)-2-(3-Hydroxy-pyrrolidin-1-yl)-cyclopentyl]-2-methoxy-6-methylsulfanyl-4-trifluoromethyl-benzamide

Product 1

HCID 66681406N-[(1RS,2SR)-2-(3-Fluoro-pyrrolidin-1-yl)-cyclopentyl]-2-methoxy-6-methylsulfanyl-4-trifluoromethyl-benzamide

Sources & evidence

ORD record
ord-5a773c51854043babec0dd5d2a39e1dd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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