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Potassium Cation → 2-({6-[(2-Hydroxy-2-methylpropoxy)methyl]pyridin-2-yl}amino)-5-[4-(methylsulfonyl)phenyl]thiophene-3-carboxamide

HRID 1234138
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HRID 1234138 반응식
[Br:20][c:21]1[cH:22][cH:23][cH:24][c:25]([CH2:27][O:28][CH2:29][C:30]([CH3:31])([OH:32])[CH3:33])[n:26]1.[C:40]([OH:41])([CH2:42][CH3:43])([CH3:44])[CH3:45].[K+:34].[K+:35].[NH2:1][c:2]1[s:3][c:4](-[c:10]2[cH:11][cH:12][c:13]([S:16](=[O:17])(=[O:18])[CH3:19])[cH:14][cH:15]2)[cH:5][c:6]1[C:7](=[O:8])[NH2:9].[O-:36][C:37]([O-:38])=[O:39]>>[NH:1]([c:2]1[s:3][c:4](-[c:10]2[cH:11][cH:12][c:13]([S:16](=[O:17])(=[O:18])[CH3:19])[cH:14][cH:15]2)[cH:5][c:6]1[C:7](=[O:8])[NH2:9])[c:21]1[cH:22][cH:23][cH:24][c:25]([CH2:27][O:28][CH2:29][C:30]([CH3:31])([OH:32])[CH3:33])[n:26]1
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참가 물질

6

반응물 5

HCID 813Potassium Cation2회HCID 64052-Methyl-2-butanolHCID 19660Carbonate IonHCID 582564812-Amino-5-[4-(methylsulfonyl)phenyl]thiophene-3-carboxamideHCID 583352721-[(6-Bromopyridin-2-yl)methoxy]-2-methylpropan-2-ol

생성물 1

HCID 59525722
2-({6-[(2-Hydroxy-2-methylpropoxy)methyl]pyridin-2-yl}amino)-5-[4-(methylsulfonyl)phenyl]thiophene-3-carboxamide

출처 및 근거

ORD 기록
ord-fac13f09196140089190c1c9b620ce5b
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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