N-Methylaniline → 5-Chloro-2-ethyl-9-methyl-13-{[methyl(phenyl)amino]methyl}-2,4,9,15-tetraazatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3,5,7,12,14-hexaen-10-one
반응식
[CH3:23][NH:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:11]([n:12]1)[N:10]([CH2:13][CH3:14])[c:9]1[c:8]([cH:18][c:17]([CH2:19][Cl:20])[cH:16][n:15]1)[C:7](=[O:21])[N:6]2[CH3:22]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:11]([n:12]1)[N:10]([CH2:13][CH3:14])[c:9]1[c:8]([cH:18][c:17]([CH2:19][N:24]([CH3:23])[c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)[cH:16][n:15]1)[C:7](=[O:21])[N:6]2[CH3:22]참가 물질
3
출처 및 근거
- ORD 기록
- ord-37c2b3a3c1aa4b00b16b95dc85082d4e
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
반응 노트
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