Dimethyl Sulfoxide → Tert-butyl {1-[4-(trifluoromethyl)pyridin-2-yl)piperidin-4-yl)carbamate

반응식

[Br:1][c:2]1[n:3][cH:4][cH:5][c:6]([C:8]([F:9])([F:10])[F:11])[cH:7]1.[CH3:26][S:27]([CH3:28])=[O:29].[NH:12]1[CH2:13][CH2:14][CH:15]([NH:18][C:19]([O:20][C:21]([CH3:22])([CH3:23])[CH3:24])=[O:25])[CH2:16][CH2:17]1>>[c:2]1([N:12]2[CH2:13][CH2:14][CH:15]([NH:18][C:19]([O:20][C:21]([CH3:22])([CH3:23])[CH3:24])=[O:25])[CH2:16][CH2:17]2)[n:3][cH:4][cH:5][c:6]([C:8]([F:9])([F:10])[F:11])[cH:7]1

참가 물질

반응물 3

HCID 679Dimethyl Sulfoxide

HCID 7238334-(N-Boc-amino)piperidine

HCID 27815432-Bromo-4-(trifluoromethyl)pyridine

생성물 1

HCID 86625877Tert-butyl {1-[4-(trifluoromethyl)pyridin-2-yl)piperidin-4-yl)carbamate

출처 및 근거

ORD 기록: ord-7a92465932b345b9be464b0a59d7e832
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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