Ammonium → N-(2-cyanoethyl)-2,2-bisfluoromethyl-6-trifluoromethyl-2H-1-benzopyran-4-carbothioamide
반응식
[Br:1][C:2]1=[CH:3][C:4]([CH2:16][F:17])([CH2:18][F:19])[O:5][c:6]2[c:7]1[cH:8][c:9]([C:12]([F:13])([F:14])[F:15])[cH:10][cH:11]2.[C:28](#[N:29])[CH2:30][CH2:31][N:32]=[C:33]=[S:34].[CH2:20]([Li:21])[CH2:22][CH2:23][CH3:24].[CH3:37][CH2:38][O:39][CH2:40][CH3:41].[Cl-:35].[Cu:25][C:26]#[N:27].[NH4+:36].[O:42]1[CH2:43][CH2:44][CH2:45][CH2:46]1>>[C:2]1([C:33]([NH:32][CH2:31][CH2:30][C:28]#[N:29])=[S:34])=[CH:3][C:4]([CH2:16][F:17])([CH2:18][F:19])[O:5][c:6]2[c:7]1[cH:8][c:9]([C:12]([F:13])([F:14])[F:15])[cH:10][cH:11]2참가 물질
9
반응물 8
생성물 1
출처 및 근거
- ORD 기록
- ord-6abee347c3254e1f80c77995edba2cc6
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
반응 노트
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