5-Amino-1-chloroisoquinoline → 1-(1-Chloro-isoquinolin-5-yl)-3-(4-trifluoromethyl-benzyl)-urea
반응식
[Cl:1][c:2]1[n:3][cH:4][cH:5][c:6]2[c:7]([NH2:12])[cH:8][cH:9][cH:10][c:11]12.[F:13][C:14]([c:15]1[cH:16][cH:17][c:18]([CH2:19][N:20]=[C:21]=[O:22])[cH:23][cH:24]1)([F:25])[F:26]>>[Cl:1][c:2]1[n:3][cH:4][cH:5][c:6]2[c:7]([NH:12][C:21]([NH:20][CH2:19][c:18]3[cH:17][cH:16][c:15]([C:14]([F:13])([F:25])[F:26])[cH:24][cH:23]3)=[O:22])[cH:8][cH:9][cH:10][c:11]12참가 물질
3
출처 및 근거
- ORD 기록
- ord-6b0307e72af24e34a934dc282a4468a3
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
반응 노트
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