4-[4-bromo-2-(trifluoromethyl)phenyl]sulfonyl-N-(1-cyanocyclopropyl)-2-(oxan-4-yloxy)cyclopentane-1-carboxamide → HCID 178510622, compound

HRID 115014Notes

Reaction equation

HRID 115014 reaction equation
[C:1](#[N:2])[C:3]1([NH:6][C:7](=[O:8])[CH:9]2[CH:10]([O:28][CH:29]3[CH2:30][CH2:31][S:32](=[O:35])(=[O:36])[CH2:33][CH2:34]3)[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:37]([C:38]1([NH:39][C:40]([CH:41]2[CH2:42][CH:43]([S:44]([c:45]3[cH:46][cH:47][c:48]([Br:49])[cH:50][c:51]3[C:52]([F:53])([F:54])[F:55])(=[O:56])=[O:57])[CH2:58][CH:59]2[O:60][CH:61]2[CH2:62][CH2:63][O:64][CH2:65][CH2:66]2)=[O:67])[CH2:68][CH2:69]1)#[N:70]>>[C:1](#[N:2])[C:3]1([NH:6][C:7](=[O:8])[CH:9]2[CH:10]([O:28][CH:29]3[CH2:30][CH2:31][S:32](=[O:35])(=[O:36])[CH2:33][CH2:34]3)[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][cH:20][cH:21][cH:22]3)[CH2:13]2)[CH2:4][CH2:5]1

Participants

3

Sources & evidence

ORD record
ord-97af77ac6e334a2a8bc4c03088672446
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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