Pyrrolidine-2-carboxamide → 1-[3-[4-[[4-(5-Fluoro-2-methoxyphenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]amino]-6-methylindazol-1-yl]benzoyl]pyrrolidine-2-carboxamide

HRID 172396

반응식

HRID 172396 반응식
[F:1][c:2]1[cH:3][cH:4][c:5]([O:39][CH3:40])[c:6]([C:8]([CH2:9][C:10]([CH2:11][NH:12][c:13]2[c:14]3[cH:15][n:16][n:17](-[c:23]4[cH:24][c:25]([C:26](=[O:27])[OH:28])[cH:29][cH:30][cH:31]4)[c:18]3[cH:19][c:20]([CH3:22])[cH:21]2)([C:32]([F:33])([F:34])[F:35])[OH:36])([CH3:37])[CH3:38])[cH:7]1.[NH:41]1[CH:42]([C:43](=[O:44])[NH2:45])[CH2:46][CH2:47][CH2:48]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([O:39][CH3:40])[c:6]([C:8]([CH2:9][C:10]([CH2:11][NH:12][c:13]2[c:14]3[cH:15][n:16][n:17](-[c:23]4[cH:24][c:25]([C:26](=[O:27])[N:41]5[CH:42]([C:43](=[O:44])[NH2:45])[CH2:46][CH2:47][CH2:48]5)[cH:29][cH:30][cH:31]4)[c:18]3[cH:19][c:20]([CH3:22])[cH:21]2)([C:32]([F:33])([F:34])[F:35])[OH:36])([CH3:37])[CH3:38])[cH:7]1

참가 물질

3

반응물 2

HCID 550774Pyrrolidine-2-carboxamideHCID 251807833-(4-{[4-[5-fluoro-2-(methyloxy)phenyl]-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]amino}-6-methyl-1H-indazol-1-yl)benzoic acid

생성물 1

HCID 734071191-[3-[4-[[4-(5-Fluoro-2-methoxyphenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]amino]-6-methylindazol-1-yl]benzoyl]pyrrolidine-2-carboxamide

출처 및 근거

ORD 기록
ord-7fbf9e20202947c1b302518f7ce80e66
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

연결된 노트

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