1,2-Dichloroethane → 4-Acetyl-3-(4-fluorophenyl)-2-(pyridin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine
Reaction equation
[CH3:23][CH2:24][N:25]([CH2:26][CH3:27])[CH2:28][CH3:29].[CH3:30][C:31](=[O:32])[O:33][C:34](=[O:35])[CH3:36].[Cl:37][CH2:38][CH2:39][Cl:40].[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9](-[c:17]3[cH:18][cH:19][n:20][cH:21][cH:22]3)[n:10][n:11]3[c:12]2[NH:13][CH2:14][CH2:15][CH2:16]3)[cH:6][cH:7]1>>[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9](-[c:17]3[cH:18][cH:19][n:20][cH:21][cH:22]3)[n:10][n:11]3[c:12]2[N:13]([C:31]([CH3:30])=[O:32])[CH2:14][CH2:15][CH2:16]3)[cH:6][cH:7]1Participants
5
Sources & evidence
- ORD record
- ord-e5707e51237448d0929611191048a38d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)