Sodium ion → N-(1-cyanocyclopropyl)-2-methoxy-4-[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]sulfonylcyclopentane-1-carboxamide

HRID 799031Notes

Reaction equation

HRID 799031 reaction equation
[C:1](#[N:2])[C:3]1([NH:6][C:7](=[O:8])[CH:9]2[CH:10]([O:28][CH3:29])[CH2:11][CH:12]([S:14](=[O:15])(=[O:16])[c:17]3[c:18]([C:24]([F:25])([F:26])[F:27])[cH:19][c:20]([Br:23])[cH:21][cH:22]3)[CH2:13]2)[CH2:4][CH2:5]1.[C:36]([c:37]1[cH:38][cH:39][cH:40][c:41]([C:42]([CH3:43])([CH3:44])[CH3:45])[n:46]1)([CH3:47])([CH3:48])[CH3:49].[C:50](=[O:51])([O-:52])[O-:53].[CH2:30]1[CH2:31][O:32][CH2:33][CH2:34][NH:35]1.[Na+:54].[Na+:55].[OH2:56]>>[C:1](#[N:2])[C:3]1([NH:6][C:7](=[O:8])[CH:9]2[CH:10]([O:28][CH3:29])[CH2:11][CH:12]([S:14](=[O:15])(=[O:16])[c:17]3[c:18]([C:24]([F:25])([F:26])[F:27])[cH:19][c:20]([N:35]4[CH2:30][CH2:31][O:32][CH2:33][CH2:34]4)[cH:21][cH:22]3)[CH2:13]2)[CH2:4][CH2:5]1

Participants

7

Reactant 6

HCID 923Sodium ion2×HCID 962WaterHCID 8083MorpholineHCID 19660Carbonate IonHCID 685102,6-Di-tert-butylpyridineHCID 723404644-[4-bromo-2-(trifluoromethyl)phenyl]sulfonyl-N-(1-cyanocyclopropyl)-2-methoxycyclopentane-1-carboxamide

Product 1

HCID 178493625N-(1-cyanocyclopropyl)-2-methoxy-4-[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]sulfonylcyclopentane-1-carboxamide

Sources & evidence

ORD record
ord-47c6080e1a7a46d2b0c85403125f388e
Source dataset
Test data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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