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Sodium Ion → N-(3-acetyl-benzo[b]thiophen-2-yl)-N-(4-fluoro-3-trifluoromethyl-benzyl)-ethanesulfonamide

HRID 1549245
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HRID 1549245 반응식
[C:3]([CH3:4])(=[O:5])[c:6]1[c:7]2[c:8]([s:9][c:10]1[NH:11][S:12](=[O:13])(=[O:14])[CH2:15][CH3:16])[cH:17][cH:18][cH:19][cH:20]2.[F:21][c:22]1[c:23]([C:30]([F:31])([F:32])[F:33])[cH:24][c:25]([CH2:26][Br:27])[cH:28][cH:29]1.[H-:1].[Na+:2].[O:35]=[CH:36][N:37]([CH3:38])[CH3:39].[OH2:34]>>[C:3]([CH3:4])(=[O:5])[c:6]1[c:7]2[c:8]([s:9][c:10]1[N:11]([S:12](=[O:13])(=[O:14])[CH2:15][CH3:16])[CH2:26][c:25]1[cH:24][c:23]([C:30]([F:31])([F:32])[F:33])[c:22]([F:21])[cH:29][cH:28]1)[cH:17][cH:18][cH:19][cH:20]2
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HCID 923Sodium IonHCID 962WaterHCID 6228DimethylformamideHCID 166653HydrideHCID 27375774-Fluoro-3-(trifluoromethyl)benzyl bromideHCID 57920498N-(3-acetyl-benzo[b]thiophen-2-yl)-ethanesulfonamide

생성물 1

출처 및 근거

ORD 기록
ord-434b1e08683143b3af057cf5e9dc5972
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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HCID 57920447
N-(3-acetyl-benzo[b]thiophen-2-yl)-N-(4-fluoro-3-trifluoromethyl-benzyl)-ethanesulfonamide