Trifluoroacetic acid → 5-Chloro-1H-indole-2-carboxylic acid (1-benzyl-2-oxo-2-piperazin-1-yl-ethyl)-amide

반응식

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

참가 물질

반응물 2

HCID 6422Trifluoroacetic acid

HCID 15521018HCID 15521018, 화합물

생성물 1

HCID 541903755-Chloro-1H-indole-2-carboxylic acid (1-benzyl-2-oxo-2-piperazin-1-yl-ethyl)-amide

출처 및 근거

ORD 기록: ord-f5ed74afc8414222a6249fd362ff6886
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

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