Benzene → 6-Chloro-1-(5-isothiazolyl)-3,4-dihydronaphthalene
반응식
[Cl:5][c:6]1[cH:7][c:8]2[c:13]([cH:14][cH:15]1)[C:12]([c:16]1[cH:17][cH:18][n:19][s:20]1)([OH:21])[CH2:11][CH2:10][CH2:9]2.[S:1]([Cl:2])([Cl:3])=[O:4].[cH:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1>>[Cl:5][c:6]1[cH:7][c:8]2[c:13]([cH:14][cH:15]1)[C:12]([c:16]1[cH:17][cH:18][n:19][s:20]1)=[CH:11][CH2:10][CH2:9]2참가 물질
4
출처 및 근거
- ORD 기록
- ord-ddc691a6525d4b3bb7f0f7d4ca74ffcb
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
반응 노트
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