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Hydrochloric Acid → N-{2-Oxo-2-[4-(2-trifluoromethyl-benzoyl)-piperazine-1-yl]-ethyl}benzamide

HRID 215258
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HRID 215258 반응식
[C:10]([c:11]1[cH:12][cH:13][cH:14][cH:15][cH:16]1)(=[O:17])[NH:18][CH2:19][C:20](=[O:21])[OH:22].[CH3:33][CH2:34][N:35]=[C:36]=[N:37][CH2:38][CH2:39][CH2:40][N:41]([CH3:42])[CH3:43].[CH:1]([N:2]([CH2:3][CH3:4])[CH:5]([CH3:6])[CH3:7])([CH3:8])[CH3:9].[ClH:44].[ClH:45].[N:46]1([C:52](=[O:53])[c:54]2[c:55]([C:60]([F:61])([F:62])[F:63])[cH:56][cH:57][cH:58][cH:59]2)[CH2:47][CH2:48][NH:49][CH2:50][CH2:51]1.[O:64]=[CH:65][N:66]([CH3:67])[CH3:68].[OH2:69].[OH:23][n:24]1[c:25]2[c:26]([cH:27][cH:28][cH:29][cH:30]2)[n:31][n:32]1>>[C:10]([c:11]1[cH:12][cH:13][cH:14][cH:15][cH:16]1)(=[O:17])[NH:18][CH2:19][C:20](=[O:22])[N:49]1[CH2:48][CH2:47][N:46]([C:52](=[O:53])[c:54]2[c:55]([C:60]([F:61])([F:62])[F:63])[cH:56][cH:57][cH:58][cH:59]2)[CH2:51][CH2:50]1
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 313Hydrochloric Acid2회HCID 464Hippuric AcidHCID 962WaterHCID 6228DimethylformamideHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-HydroxybenzotriazoleHCID 81531Diisopropylethylamine
HCID 16733784
1-[2-(Trifluoromethyl)benzoyl]piperazine

생성물 1

HCID 59559588N-{2-Oxo-2-[4-(2-trifluoromethyl-benzoyl)-piperazine-1-yl]-ethyl}benzamide

출처 및 근거

ORD 기록
ord-0b34582bd4a84e629269ce17cb231580
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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