Sulfuryl chloride → 4-Acryloyl-2-chloro-7-methoxy-2,3,4,5-tetrahydro-1,4-benzothiazepine
반응식
[C:1]([CH:2]=[CH2:3])(=[O:4])[N:5]1[CH2:6][CH2:7][S:8][c:9]2[c:10]([cH:12][c:13]([O:16][CH3:17])[cH:14][cH:15]2)[CH2:11]1.[S:18]([Cl:19])(=[O:20])([Cl:21])=[O:22]>>[C:1]([CH:2]=[CH2:3])(=[O:4])[N:5]1[CH2:6][CH:7]([Cl:21])[S:8][c:9]2[c:10]([cH:12][c:13]([O:16][CH3:17])[cH:14][cH:15]2)[CH2:11]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-1be650e94d984f60be1a5619873a3795
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
반응 노트
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