Toluene → 1-(5-Tert-butylisoxazol-3-yl)-3-(4-fluoro-3-hydroxyphenyl)urea
반응식
[C:10]([CH3:11])([CH3:12])([CH3:13])[c:14]1[cH:15][c:16]([N:19]=[C:20]=[O:21])[n:17][o:18]1.[CH3:22][c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1.[NH2:1][c:2]1[cH:3][cH:4][c:5]([F:9])[c:6]([OH:8])[cH:7]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([F:9])[c:6]([OH:8])[cH:7]1)[C:20]([NH:19][c:16]1[cH:15][c:14]([C:10]([CH3:11])([CH3:12])[CH3:13])[o:18][n:17]1)=[O:21]참가 물질
4
출처 및 근거
- ORD 기록
- ord-7022eb5d867b4d1eb718281bb1f232bd
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
반응 노트
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