Methane → 3-[6-(4-Amino-2-fluorophenoxy)pyrimidin-4-yl]-1-(3-diethylaminopropyl)-1-methylurea
반응식
[C:38].[F:1][c:2]1[c:3]([O:4][c:5]2[cH:6][c:7]([NH:11][C:12]([N:13]([CH3:14])[CH2:15][CH2:16][CH2:17][N:18]([CH2:19][CH3:20])[CH2:21][CH3:22])=[O:23])[n:8][cH:9][n:10]2)[cH:24][cH:25][c:26]([N+:28]([O-:29])=[O:30])[cH:27]1.[H:31][H:32].[O:33]1[CH2:34][CH2:35][CH2:36][CH2:37]1.[Pd:39]>>[F:1][c:2]1[c:3]([O:4][c:5]2[cH:6][c:7]([NH:11][C:12]([N:13]([CH3:14])[CH2:15][CH2:16][CH2:17][N:18]([CH2:19][CH3:20])[CH2:21][CH3:22])=[O:23])[n:8][cH:9][n:10]2)[cH:24][cH:25][c:26]([NH2:28])[cH:27]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-4a918b7d931c4593b66563ade8802511
- 출처 데이터셋
- Validation data from https://doi.org/10.1039/C8SC04228D
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