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Dimethyl Sulfoxide → N-(4-(((4,4-Difluorocyclohexyl)methyl)amino)-3-nitrophenyl)ethanesulfonamide

HRID 694645
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HRID 694645 반응식
[CH3:27][S:28]([CH3:29])=[O:30].[F:17][C:18]1([F:26])[CH2:19][CH2:20][CH:21]([CH2:24][NH2:25])[CH2:22][CH2:23]1.[F:1][c:2]1[c:3]([N+:14](=[O:15])[O-:16])[cH:4][c:5]([NH:8][S:9](=[O:10])(=[O:11])[CH2:12][CH3:13])[cH:6][cH:7]1.[NH2:31][CH2:32][CH2:33][OH:34].[OH2:35]>>[c:2]1([NH:25][CH2:24][CH:21]2[CH2:20][CH2:19][C:18]([F:17])([F:26])[CH2:23][CH2:22]2)[c:3]([N+:14](=[O:15])[O-:16])[cH:4][c:5]([NH:8][S:9](=[O:10])(=[O:11])[CH2:12][CH3:13])[cH:6][cH:7]1
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반응물 5

HCID 679Dimethyl SulfoxideHCID 700EthanolamineHCID 962WaterHCID 3286362N-(4-fluoro-3-nitrophenyl)ethanesulfonamideHCID 15604494(4,4-Difluorocyclohexyl)methanamine

생성물 1

HCID 11516373N-(4-(((4,4-Difluorocyclohexyl)methyl)amino)-3-nitrophenyl)ethanesulfonamide

출처 및 근거

ORD 기록
ord-3401a0b014cb4955a44da758cb7d14dc
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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