Trifluoroacetic acid → 7-amino-4-cyano-N,N,5-trimethyl-6-phenyl-1,3-benzoxazole-2-carboxamide

반응식

[C:1](#[N:2])[c:3]1[c:4]([CH3:33])[c:5](-[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[c:6]([NH:17][CH2:18][c:19]2[cH:20][cH:21][c:22]([O:23][CH3:24])[cH:25][cH:26]2)[c:7]2[c:8]1[n:9][c:10]([C:12](=[O:13])[N:14]([CH3:15])[CH3:16])[o:11]2.[OH:34][C:35]([C:36]([F:37])([F:38])[F:39])=[O:40]>>[C:1](#[N:2])[c:3]1[c:4]([CH3:33])[c:5](-[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[c:6]([NH2:17])[c:7]2[c:8]1[n:9][c:10]([C:12](=[O:13])[N:14]([CH3:15])[CH3:16])[o:11]2

참가 물질

반응물 2

HCID 6422Trifluoroacetic acid

HCID 685855194-Cyano-7-(4-methoxybenzylamino)-N,N,5-trimethyl-6-phenyl-1,3-benzoxazole-2-carboxamide

생성물 1

HCID 685844087-amino-4-cyano-N,N,5-trimethyl-6-phenyl-1,3-benzoxazole-2-carboxamide

출처 및 근거

ORD 기록: ord-3bf523c1c83241fe92a3c3648c443b36
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

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