Sodium ion → 4-chloro-6-(2-pyrrol-1-yl-benzylamino)-2H-phthalazin-1-one
Reaction equation
[Br:1][c:2]1[cH:3][c:4]2[c:5]([Cl:13])[n:6][nH:7][c:8](=[O:12])[c:9]2[cH:10][cH:11]1.[CH3:27][C:28]([CH3:29])([O-:30])[CH3:31].[CH3:33][CH2:34][O:35][C:36]([CH3:37])=[O:38].[Na+:32].[O:41]=[C:42]([CH:43]=[CH:44][c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1)[CH:51]=[CH:52][c:53]1[cH:54][cH:55][cH:56][cH:57][cH:58]1.[O:59]=[C:60]([CH:61]=[CH:62][c:63]1[cH:64][cH:65][cH:66][cH:67][cH:68]1)[CH:69]=[CH:70][c:71]1[cH:72][cH:73][cH:74][cH:75][cH:76]1.[O:77]=[C:78]([CH:79]=[CH:80][c:81]1[cH:82][cH:83][cH:84][cH:85][cH:86]1)[CH:87]=[CH:88][c:89]1[cH:90][cH:91][cH:92][cH:93][cH:94]1.[Pd:39].[Pd:40].[n:14]1(-[c:19]2[c:20]([CH2:21][NH2:22])[cH:23][cH:24][cH:25][cH:26]2)[cH:15][cH:16][cH:17][cH:18]1>>[c:2]1([NH:22][CH2:21][c:20]2[c:19](-[n:14]3[cH:15][cH:16][cH:17][cH:18]3)[cH:26][cH:25][cH:24][cH:23]2)[cH:3][c:4]2[c:5]([Cl:13])[n:6][nH:7][c:8](=[O:12])[c:9]2[cH:10][cH:11]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-c213e8d6d4674eb5ac84dde7f7ea2c3a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
Loading…