Hydrochloric Acid → N-(3-chloro-4-morpholin-4-ylphenyl)-2-[2-(4-methylpiperazin-1-yl)ethyl]-4,5-dihydro-2H-pyrimido[5',4':4,5]thieno[2,3-e]indazol-6-amine
반응식
[CH:48]([OH:49])([CH3:50])[CH3:51].[Cl:1][c:2]1[n:3][cH:4][n:5][c:6]2[c:7]1[c:8]1[c:9]([s:26]2)-[c:10]2[cH:11][n:12]([CH2:17][CH2:18][N:19]3[CH2:20][CH2:21][N:22]([CH3:25])[CH2:23][CH2:24]3)[n:13][c:14]2[CH2:15][CH2:16]1.[Cl:27][c:28]1[cH:29][c:30]([NH2:31])[cH:32][cH:33][c:34]1[N:35]1[CH2:36][CH2:37][O:38][CH2:39][CH2:40]1.[ClH:41].[O:42]1[CH2:43][CH2:44][O:45][CH2:46][CH2:47]1>>[c:2]1([NH:31][c:30]2[cH:29][c:28]([Cl:27])[c:34]([N:35]3[CH2:36][CH2:37][O:38][CH2:39][CH2:40]3)[cH:33][cH:32]2)[n:3][cH:4][n:5][c:6]2[c:7]1[c:8]1[c:9]([s:26]2)-[c:10]2[cH:11][n:12]([CH2:17][CH2:18][N:19]3[CH2:20][CH2:21][N:22]([CH3:25])[CH2:23][CH2:24]3)[n:13][c:14]2[CH2:15][CH2:16]1참가 물질
6
반응물 5
생성물 1
출처 및 근거
- ORD 기록
- ord-b61cf7c171a849209ad6c4fb078448a8
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
반응 노트
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