반응식
[CH2:23]([CH2:24][CH2:25][CH3:26])[c:27]1[cH:28][cH:29][c:30]([N:33]2[CH2:34][CH2:35][NH:36][CH2:37][CH2:38]2)[cH:31][cH:32]1.[CH3:1][O:2][c:3]1[n:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]2[n:11][c:12]1[NH:13][C:14]([O:15][c:16]1[cH:17][cH:18][cH:19][cH:20][cH:21]1)=[S:22]>>[CH3:1][O:2][c:3]1[n:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]2[n:11][c:12]1[NH:13][C:14](=[S:22])[N:36]1[CH2:35][CH2:34][N:33]([c:30]2[cH:29][cH:28][c:27]([CH2:23][CH2:24][CH2:25][CH3:26])[cH:32][cH:31]2)[CH2:38][CH2:37]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-f8f30082cecc4f21abc98582a2c59772
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
연결된 노트
불러오는 중…