반응식
[CH3:10][c:11]1[c:12]([N:20]=[C:21]=[S:22])[cH:13][cH:14][c:15]([N+:17](=[O:18])[O-:19])[cH:16]1.[CH:2]1([CH2:5][NH2+:6][CH2:7][CH2:8][Cl:9])[CH2:3][CH2:4]1.[Cl-:1]>>[CH:2]1([CH2:5][N:6]2[CH2:7][CH2:8][S:22][C:21]2=[N:20][c:12]2[c:11]([CH3:10])[cH:16][c:15]([N+:17](=[O:18])[O-:19])[cH:14][cH:13]2)[CH2:3][CH2:4]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-59693ec328ea4c88aee47cb776de5f78
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
연결된 노트
불러오는 중…