4-Bromo-2-fluoroaniline → Jtp-70902

반응식

[CH:1]1([n:4]2[c:5](=[O:39])[n:6](-[c:28]3[cH:29][c:30]([NH:34][S:35](=[O:36])(=[O:37])[CH3:38])[cH:31][cH:32][cH:33]3)[c:7]3[c:8]([c:9]2=[O:10])[c:11]([O:17][S:18]([c:19]2[cH:20][cH:21][c:22]([CH3:23])[cH:24][cH:25]2)(=[O:26])=[O:27])[cH:12][c:13](=[O:16])[n:14]3[CH3:15])[CH2:2][CH2:3]1.[F:40][c:41]1[c:42]([NH2:43])[cH:44][cH:45][c:46]([Br:48])[cH:47]1>>[CH:1]1([n:4]2[c:5](=[O:39])[n:6](-[c:28]3[cH:29][c:30]([NH:34][S:35](=[O:36])(=[O:37])[CH3:38])[cH:31][cH:32][cH:33]3)[c:7]3[c:8]([c:9]2=[O:10])[c:11]([NH:43][c:42]2[c:41]([F:40])[cH:47][c:46]([Br:48])[cH:45][cH:44]2)[cH:12][c:13](=[O:16])[n:14]3[CH3:15])[CH2:2][CH2:3]1

참가 물질

반응물 2

HCID 1230504-Bromo-2-fluoroaniline

HCID 59717043HCID 59717043, 화합물

생성물 1

HCID 11527186Jtp-70902

출처 및 근거

ORD 기록: ord-d26f15aa41674479b439414369cefca0
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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