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Bicarbonate Ion → N-butyl-N-(1H-benzoimidazol-2-ylmethyl)-2,3-difluorobenzamide

HRID 136724
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HRID 136724 반응식
[CH2:1]([CH2:2][CH2:3][CH3:4])[NH:5][CH2:6][c:7]1[nH:8][c:9]2[c:10]([n:11]1)[cH:12][cH:13][cH:14][cH:15]2.[CH3:32][c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1.[CH3:39][CH2:40][O:41][C:42](=[O:43])[CH3:44].[F:21][c:22]1[c:23]([C:24](=[O:25])[Cl:26])[cH:27][cH:28][cH:29][c:30]1[F:31].[Na+:20].[O-:16][C:17]([OH:18])=[O:19]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[N:5]([CH2:6][c:7]1[nH:8][c:9]2[c:10]([n:11]1)[cH:12][cH:13][cH:14][cH:15]2)[C:24]([c:23]1[c:22]([F:21])[c:30]([F:31])[cH:29][cH:28][cH:27]1)=[O:25]
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7

반응물 6

HCID 769Bicarbonate IonHCID 923Sodium IonHCID 1140TolueneHCID 8857Ethyl AcetateHCID 5195492,3-Difluorobenzoyl chlorideHCID 131694082-Butylaminomethylbenzimidazole

생성물 1

HCID 22394018N-butyl-N-(1H-benzoimidazol-2-ylmethyl)-2,3-difluorobenzamide

출처 및 근거

ORD 기록
ord-984b56b66e7a40efa173fc5f7e5a41fc
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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