Benzaldehyde → 2-Benzylamino-3-cyano-4-methyl-5-(2-fluorophenyl)pyrrole
반응식
[CH2:31]([Cl:32])[Cl:33].[CH:23](=[O:24])[c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1.[Mg+2:17].[NH2:1][c:2]1[nH:3][c:4](-[c:10]2[c:11]([F:16])[cH:12][cH:13][cH:14][cH:15]2)[c:5]([CH3:9])[c:6]1[C:7]#[N:8].[O-:18][S:19](=[O:20])(=[O:21])[O-:22]>>[NH:1]([c:2]1[nH:3][c:4](-[c:10]2[c:11]([F:16])[cH:12][cH:13][cH:14][cH:15]2)[c:5]([CH3:9])[c:6]1[C:7]#[N:8])[CH2:23][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-338799648d6648c7936e7fa5761c30d6
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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