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Water → N-[[2-(2,2-dimethoxypropyl)phenyl]-[4-(trifluoromethyl)phenyl]methyl]-2-methylpropane-2-sulfinamide

HRID 309186
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HRID 309186 반응식
[Br:1][c:2]1[c:3]([CH2:8][C:9]([CH3:10])([O:11][CH3:12])[O:13][CH3:14])[cH:4][cH:5][cH:6][cH:7]1.[C:15]([Li:16])([CH3:17])([CH3:18])[CH3:19].[CH2:39]1[O:40][CH2:41][CH2:42][CH2:43]1.[F:20][C:21]([c:22]1[cH:23][cH:24][c:25]([CH:26]=[N:27][S:28](=[O:29])[C:30]([CH3:31])([CH3:32])[CH3:33])[cH:34][cH:35]1)([F:36])[F:37].[OH2:38]>>[c:2]1([CH:26]([c:25]2[cH:24][cH:23][c:22]([C:21]([F:20])([F:36])[F:37])[cH:35][cH:34]2)[NH:27][S:28](=[O:29])[C:30]([CH3:31])([CH3:32])[CH3:33])[c:3]([CH2:8][C:9]([CH3:10])([O:11][CH3:12])[O:13][CH3:14])[cH:4][cH:5][cH:6][cH:7]1
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HCID 962WaterHCID 8028TetrahydrofuranHCID 595364291-Bromo-2-(2,2-dimethoxypropyl)benzeneHCID 68419343N-(tert-Butylsulfinyl)-4-(trifluoromethyl)benzenemethaneimineHCID 178418306HCID 178418306, 화합물

생성물 1

HCID 68870137N-[[2-(2,2-dimethoxypropyl)phenyl]-[4-(trifluoromethyl)phenyl]methyl]-2-methylpropane-2-sulfinamide

출처 및 근거

ORD 기록
ord-dae2e30b2f3b4fef9a770dc03d347e7b
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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