Hydrochloric Acid → N-[2-[4-[4-[2-(1H-indazol-3-yl)ethenyl]benzoyl]piperazin-1-yl]-2-oxoethyl]-N-methylacetamide
반응식
[C:56]([CH3:57])(=[O:58])[N:59]([CH3:60])[CH2:61][C:62](=[O:63])[OH:64].[CH2:34]([N:35]=[C:36]=[N:37][CH2:38][CH2:39][CH2:40][N:41]([CH3:42])[CH3:43])[CH3:44].[CH3:26][N:27]1[CH2:28][CH2:29][O:30][CH2:31][CH2:32]1.[ClH:33].[OH2:45].[OH:46][n:47]1[c:48]2[cH:49][cH:50][cH:51][cH:52][c:53]2[n:54][n:55]1.[nH:1]1[n:2][c:3]([CH:10]=[CH:11][c:12]2[cH:13][cH:14][c:15]([C:16](=[O:17])[N:18]3[CH2:19][CH2:20][NH:21][CH2:22][CH2:23]3)[cH:24][cH:25]2)[c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]12>>[nH:1]1[n:2][c:3]([CH:10]=[CH:11][c:12]2[cH:13][cH:14][c:15]([C:16](=[O:17])[N:18]3[CH2:19][CH2:20][N:21]([C:62]([CH2:61][N:59]([C:56]([CH3:57])=[O:58])[CH3:60])=[O:63])[CH2:22][CH2:23]3)[cH:24][cH:25]2)[c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]12참가 물질
8
반응물 7
생성물 1
출처 및 근거
- ORD 기록
- ord-8e850e3e4f63416b85e10435ccfb592f
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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