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Dichloromethane → 4-Methyl-pentanoic acid {4-[4-(ethylcarbamoyl-phenyl-methyl)-piperazin-1-yl]-3-fluoro-phenyl}-amide

HRID 1120720
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인쇄 미리보기

반응식

HRID 1120720 반응식
[CH3:27][CH:28]([CH2:29][CH2:30][C:31](=[O:32])[Cl:33])[CH3:34].[Cl:35][CH2:36][Cl:37].[NH2:1][c:2]1[cH:3][c:4]([F:26])[c:5]([N:8]2[CH2:9][CH2:10][N:11]([CH:14]([C:15](=[O:16])[NH:17][CH2:18][CH3:19])[c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[CH2:12][CH2:13]2)[cH:6][cH:7]1>>[NH:1]([c:2]1[cH:3][c:4]([F:26])[c:5]([N:8]2[CH2:9][CH2:10][N:11]([CH:14]([C:15](=[O:16])[NH:17][CH2:18][CH3:19])[c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[CH2:12][CH2:13]2)[cH:6][cH:7]1)[C:31]([CH2:30][CH2:29][CH:28]([CH3:27])[CH3:34])=[O:32]
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참가 물질

4

반응물 3

HCID 6344DichloromethaneHCID 170008Pentanoyl chloride, 4-methyl-HCID 669319332-[4-(4-amino-2-fluoro-phenyl)-piperazin-1-yl]-N-ethyl-2-phenyl-acetamide

생성물 1

HCID 166666824-Methyl-pentanoic acid {4-[4-(ethylcarbamoyl-phenyl-methyl)-piperazin-1-yl]-3-fluoro-phenyl}-amide

출처 및 근거

ORD 기록
ord-499fdb535a87421d80cf38b510b69630
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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