4-[4-bromo-2-(trifluoromethyl)phenyl]sulfonyl-N-(1-cyanocyclopropyl)-2-(oxan-4-yloxy)cyclopentane-1-carboxamide → HCID 178510621, 화합물
반응식
[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][CH2:32]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:33]([C:34]1([NH:35][C:36]([CH:37]2[CH2:38][CH:39]([S:40]([c:41]3[cH:42][cH:43][c:44]([Br:45])[cH:46][c:47]3[C:48]([F:49])([F:50])[F:51])(=[O:52])=[O:53])[CH2:54][CH:55]2[O:56][CH:57]2[CH2:58][CH2:59][O:60][CH2:61][CH2:62]2)=[O:63])[CH2:64][CH2:65]1)#[N:66]>>[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][CH2:32]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]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-d6b29ab174da453fb796831dbf672411
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
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