[2-(4-Chloro-benzoylamino)-thiazol-4-yl]-acetic acid → 4-chloro-N-{4-[2-(4-dimethylcarbamoylmethyl-piperazin-1-yl)-2-oxo-ethyl]-thiazol-2-yl}-benzamide

반응식

[CH3:20][N:21]([C:22]([CH2:23][N:24]1[CH2:25][CH2:26][NH:27][CH2:28][CH2:29]1)=[O:30])[CH3:31].[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[NH:8][c:9]2[s:10][cH:11][c:12]([CH2:14][C:15](=[O:16])[OH:17])[n:13]2)[cH:18][cH:19]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[NH:8][c:9]2[s:10][cH:11][c:12]([CH2:14][C:15](=[O:17])[N:27]3[CH2:26][CH2:25][N:24]([CH2:23][C:22]([N:21]([CH3:20])[CH3:31])=[O:30])[CH2:29][CH2:28]3)[n:13]2)[cH:18][cH:19]1

참가 물질

반응물 2

HCID 677042[2-(4-Chloro-benzoylamino)-thiazol-4-yl]-acetic acid

HCID 2758642N,N-dimethyl-2-(piperazin-1-yl)acetamide

생성물 1

HCID 596988864-chloro-N-{4-[2-(4-dimethylcarbamoylmethyl-piperazin-1-yl)-2-oxo-ethyl]-thiazol-2-yl}-benzamide

출처 및 근거

ORD 기록: ord-f55e29251a09473da30ef830cf416a80
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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