Dichloromethane → 1-(3-Chloro-4-methylphenyl)-3-(4-((isopropyl(methyl)amino)methyl)thiazol-2-YL)urea
반응식
[CH:1]([CH3:2])([CH3:3])[N:4]([CH3:5])[CH2:6][c:7]1[n:8][c:9]([NH2:12])[s:10][cH:11]1.[Cl:13][c:14]1[cH:15][c:16]([N:21]=[C:22]=[O:23])[cH:17][cH:18][c:19]1[CH3:20].[Cl:24][CH2:25][Cl:26]>>[CH:1]([CH3:2])([CH3:3])[N:4]([CH3:5])[CH2:6][c:7]1[n:8][c:9]([NH:12][C:22]([NH:21][c:16]2[cH:15][c:14]([Cl:13])[c:19]([CH3:20])[cH:18][cH:17]2)=[O:23])[s:10][cH:11]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-d087e27134b440478dd594f7298e27c3
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
반응 노트
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