Hydrochloric Acid → Hydrochloric Acid
반응식
[CH3:17][CH:18]([CH2:19][NH:20][C:21]1=[N:25][C:24](=[NH:26])[CH2:23][S:22]1)[CH2:27][CH3:28].[CH3:1][O:2][c:3]1[c:4]2[c:8]([c:9]([O:12][CH3:13])[cH:10][cH:11]1)[C:7](=[NH:14])[NH:6][C:5]2=[NH:15].[ClH:16].[ClH:40].[N:41]1([C:42]2=[N:47][C:45](=[NH:46])[CH2:44][S:43]2)[CH2:48][CH2:49][CH2:50][CH2:51][CH2:52]1.[NH:29]=[C:30]1[c:31]2[c:32]([cH:33][cH:34][cH:35][cH:36]2)[C:37](=[NH:38])[NH:39]1>>[CH3:1][O:2][c:3]1[c:4]2[c:8]([c:9]([O:12][CH3:13])[cH:10][cH:11]1)[C:7](=[NH:14])[NH:6][C:5]2=[C:23]1[S:22][C:21]([NH:20][CH2:19][CH:18]([CH3:17])[CH2:27][CH3:28])=[N:25][C:24]1=[NH:26].[ClH:16]참가 물질
7
출처 및 근거
- ORD 기록
- ord-bd2c122a4ae24f3eb3676be2118476b6
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
반응 노트
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