Dimethylformamide → Ethyl-[2-(4-isothiocyanato-phenoxy)-ethyl]-carbamic acid tert-butyl ester
반응식
[C:13]([CH3:14])([CH3:15])([CH3:16])[O:17][C:18]([N:19]([CH2:20][CH3:21])[CH2:22][CH2:23][O:24][c:25]1[cH:26][cH:27][c:28]([NH2:31])[cH:29][cH:30]1)=[O:32].[C:1](=[S:2])([c:3]1[nH:4][cH:5][cH:6][n:7]1)[c:8]1[nH:9][cH:10][cH:11][n:12]1.[CH3:33][N:34]([CH3:35])[CH:36]=[O:37]>>[C:1](=[S:2])=[N:31][c:28]1[cH:27][cH:26][c:25]([O:24][CH2:23][CH2:22][N:19]([C:18]([O:17][C:13]([CH3:14])([CH3:15])[CH3:16])=[O:32])[CH2:20][CH3:21])[cH:30][cH:29]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-06a5293ba63d405188063ac2fa5bebd6
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
반응 노트
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