Trifluoroacetic acid → N-Benzothiazol-6-yl-2-(2-methoxy-phenyl)-N-[2-(4-trifluoromethyl-phenyl)-ethyl]-acetamide

반응식

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

참가 물질

반응물 3

HCID 6422Trifluoroacetic acid

HCID 71342-Methoxyphenylacetic acid

HCID 57570295Benzothiazol-6-yl-[2-(4-trifluoromethyl-phenyl)-ethyl]-amine

생성물 1

HCID 57570438N-Benzothiazol-6-yl-2-(2-methoxy-phenyl)-N-[2-(4-trifluoromethyl-phenyl)-ethyl]-acetamide

출처 및 근거

ORD 기록: ord-d361347a1b3a45c0b6dbfb7a280c0c33
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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