Diisopropylethylamine → Methyl 2-(2-tert-butyl-5-methyl-7-(4-trifluoromethylphenyl)pyrazolo[1,5-a]pyrimidin-6-yl)pentanoate
反応式
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][n:7]2[c:8]([n:9][c:10]([CH3:22])[c:11]([CH:14]([C:15](=[O:16])[O:17][CH3:18])[CH2:19][CH2:20][CH3:21])[c:12]2[Cl:13])[cH:23]1.[CH:37]([N:38]([CH:39]([CH3:40])[CH3:41])[CH2:42][CH3:43])([CH3:44])[CH3:45].[F:24][C:25]([c:26]1[cH:27][cH:28][c:29]([B:32]([OH:33])[OH:34])[cH:30][cH:31]1)([F:35])[F:36]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][n:7]2[c:8]([n:9][c:10]([CH3:22])[c:11]([CH:14]([C:15](=[O:16])[O:17][CH3:18])[CH2:19][CH2:20][CH3:21])[c:12]2-[c:29]2[cH:28][cH:27][c:26]([C:25]([F:24])([F:35])[F:36])[cH:31][cH:30]2)[cH:23]1参加物
4
出典と根拠
- ORDレコード
- ord-6a4a4636e7d04a7c8752f2cbee0aa526
- 出典データセット
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
- DOI