Acetonitrile → 1-(4-Hydroxybutyl)-3-(3-phenylthioureido)pyrazole
반응식
[CH3:21][C:22]#[N:23].[NH2:1][c:2]1[n:3][n:4]([CH2:7][CH2:8][CH2:9][CH2:10][OH:11])[cH:5][cH:6]1.[c:12]1([N:18]=[C:19]=[S:20])[cH:13][cH:14][cH:15][cH:16][cH:17]1>>[NH:1]([c:2]1[n:3][n:4]([CH2:7][CH2:8][CH2:9][CH2:10][OH:11])[cH:5][cH:6]1)[C:19]([NH:18][c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1)=[S:20]참가 물질
4
출처 및 근거
- ORD 기록
- ord-aeb547a80c7a4c068872f99aa0420c24
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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