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Hydrochloric Acid → 2-acetoxy-5-chloro-N-({[3,5-bis(trifluoromethyl)phenyl]carbamoyl)methyl)benzamide

HRID 2130305
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인쇄 미리보기

반응식

HRID 2130305 반응식
[C:1]([CH3:2])(=[O:3])[O:4][c:5]1[c:6]([C:7](=[O:8])[OH:9])[cH:10][c:11]([Cl:14])[cH:12][cH:13]1.[CH3:46][N:47]([CH3:48])[CH:49]=[O:50].[ClH:15].[ClH:45].[NH2:16][CH2:17][C:18](=[O:19])[NH:20][c:21]1[cH:22][c:23]([C:31]([F:32])([F:33])[F:34])[cH:24][c:25]([C:27]([F:28])([F:29])[F:30])[cH:26]1.[OH:35][n:36]1[c:37]2[cH:38][cH:39][cH:40][cH:41][c:42]2[n:43][n:44]1>>[C:1]([CH3:2])(=[O:3])[O:4][c:5]1[c:6]([C:7](=[O:9])[NH:16][CH2:17][C:18](=[O:19])[NH:20][c:21]2[cH:22][c:23]([C:31]([F:32])([F:33])[F:34])[cH:24][c:25]([C:27]([F:28])([F:29])[F:30])[cH:26]2)[cH:10][c:11]([Cl:14])[cH:12][cH:13]1
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 313Hydrochloric Acid2회HCID 6228DimethylformamideHCID 757711-HydroxybenzotriazoleHCID 28208132-(Acetyloxy)-5-chlorobenzoic acidHCID 574592642-amino-N-[3,5-bis(trifluoromethyl)phenyl]acetamide

생성물 1

HCID 230699552-acetoxy-5-chloro-N-({[3,5-bis(trifluoromethyl)phenyl]carbamoyl)methyl)benzamide

출처 및 근거

ORD 기록
ord-3e4ff0d93b6f4057a9018840e3651cef
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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