tert-Butyl piperazine-1-carboxylate → 2-benzyl-4-(4-tert-butoxycarbonyl-1-piperazinyl)methyl-6-(4-fluoro-3-methylphenyl)-2H-pyridazin-3-one
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([c:14]2[c:15](=[O:16])[n:17]([CH2:18][CH:19]([CH3:20])[CH3:21])[n:22][c:23](-[c:24]3[cH:25][cH:26][c:27]([CH3:28])[c:29]([F:30])[cH:31]3)[c:32]2[CH3:33])[CH2:12][CH2:13]1.[CH2:34]([c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1)[n:41]1[n:42][c:43](-[c:54]2[cH:55][c:56]([CH3:61])[c:57]([F:60])[cH:58][cH:59]2)[cH:44][c:45]([CH2:48][O:49][S:50]([CH3:51])(=[O:52])=[O:53])[c:46]1=[O:47].[N:62]1([C:63]([O:64][C:65]([CH3:66])([CH3:67])[CH3:68])=[O:69])[CH2:70][CH2:71][NH:72][CH2:73][CH2:74]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([CH2:48][c:45]2[cH:44][c:43](-[c:54]3[cH:55][c:56]([CH3:61])[c:57]([F:60])[cH:58][cH:59]3)[n:42][n:41]([CH2:34][c:35]3[cH:36][cH:37][cH:38][cH:39][cH:40]3)[c:46]2=[O:47])[CH2:12][CH2:13]1Participants
4
Reactant 3
Product 1
Sources & evidence
- ORD record
- ord-d8f603aa8bcc46e1b00741180ef34c87
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
Loading…