3-Oxo-3-(3-[1,2,3)triazol-1-yl-phenyl)-propionic acid ethyl ester → HCID 86586820, 화합물

반응식

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[cH:9][c:10]([O:22][CH2:23][C:24]([F:25])([F:26])[F:27])[c:11](-[c:15]2[c:16]([F:21])[cH:17][cH:18][cH:19][cH:20]2)[cH:12][c:13]1[NH2:14])=[O:28].[CH2:29]([O:31][C:32](=[O:30])[CH2:33][C:34]([c:35]1[cH:36][c:37](-[n:41]2[n:42][n:43][cH:44][cH:45]2)[cH:38][cH:39][cH:40]1)=[O:46])[CH3:47]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[cH:9][c:10]([O:22][CH2:23][C:24]([F:25])([F:26])[F:27])[c:11](-[c:15]2[c:16]([F:21])[cH:17][cH:18][cH:19][cH:20]2)[cH:12][c:13]1[NH:14][C:32](=[O:31])[CH2:33][C:34]([c:35]1[cH:36][c:37](-[n:41]2[n:42][n:43][cH:44][cH:45]2)[cH:38][cH:39][cH:40]1)=[O:46])=[O:28]

참가 물질

반응물 2

HCID 695928683-Oxo-3-(3-[1,2,3)triazol-1-yl-phenyl)-propionic acid ethyl ester

HCID 69688642[5-Amino-2'-fluoro-2-(2,2,2-trifluoro-ethoxy)-biphenyl-4-yl]-carbamic acid tert.-butyl ester

생성물 1

HCID 86586820HCID 86586820, 화합물

출처 및 근거

ORD 기록: ord-9bf71283fae941c6a5b4d2d6ce41de0d
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

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