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Sodium Ion → 3,5-Dichloro-N-(4-fluorobenzyl)-N-(4-((4-fluorobenzylamino)methyl)benzyl)-2-hydroxybenzenesulfonamide

HRID 115742
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HRID 115742 반응식
[BH4-:43].[CH:45]([OH:46])([CH3:47])[CH3:48].[Cl:31][CH2:32][Cl:33].[F:34][c:35]1[cH:36][cH:37][c:38]([CH:39]=[O:40])[cH:41][cH:42]1.[NH2:1][CH2:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][N:8]([S:9](=[O:10])(=[O:11])[c:12]2[c:13]([OH:20])[c:14]([Cl:19])[cH:15][c:16]([Cl:18])[cH:17]2)[CH2:21][c:22]2[cH:23][cH:24][c:25]([F:28])[cH:26][cH:27]2)[cH:29][cH:30]1.[Na+:44]>>[NH:1]([CH2:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][N:8]([S:9](=[O:10])(=[O:11])[c:12]2[c:13]([OH:20])[c:14]([Cl:19])[cH:15][c:16]([Cl:18])[cH:17]2)[CH2:21][c:22]2[cH:23][cH:24][c:25]([F:28])[cH:26][cH:27]2)[cH:29][cH:30]1)[CH2:39][c:38]1[cH:37][cH:36][c:35]([F:34])[cH:42][cH:41]1
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반응물 6

HCID 923Sodium IonHCID 3776IsopropanolHCID 6344DichloromethaneHCID 28123BorohydrideHCID 680234-FluorobenzaldehydeHCID 58531430N-(4-(Aminomethyl)benzyl)-3,5-dichloro-N-(4-fluorobenzyl)-2-hydroxybenzenesulfonamide

생성물 1

HCID 58531418
3,5-Dichloro-N-(4-fluorobenzyl)-N-(4-((4-fluorobenzylamino)methyl)benzyl)-2-hydroxybenzenesulfonamide

출처 및 근거

ORD 기록
ord-542db4096c8045b4bfa3caf1586c57b8
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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