Acetic Acid → Tert-butyl 4-{[5-(2-chlorophenyl)-1-(2,6-dichlorophenyl)-2-oxo-1,2,3,4-tetrahydroquinazolin-7-yl]methyl}-3-methylpiperazine-1-carboxylate
Reaction equation
[C:29](=[O:30])([O:31][C:32]([CH3:33])([CH3:34])[CH3:35])[N:36]1[CH2:37][CH:38]([CH3:42])[NH:39][CH2:40][CH2:41]1.[C:43]([O:44][BH-:45]([O:46][C:47](=[O:48])[CH3:49])[O:50][C:51](=[O:52])[CH3:53])(=[O:54])[CH3:55].[CH3:57][C:58](=[O:59])[OH:60].[Cl:1][c:2]1[c:3](-[c:8]2[c:9]3[c:14]([cH:15][c:16]([CH:18]=[O:19])[cH:17]2)[N:13]([c:20]2[c:21]([Cl:27])[cH:22][cH:23][cH:24][c:25]2[Cl:26])[C:12](=[O:28])[NH:11][CH2:10]3)[cH:4][cH:5][cH:6][cH:7]1.[Cl:61][CH:62]([Cl:63])[CH3:64].[Na+:56]>>[Cl:1][c:2]1[c:3](-[c:8]2[c:9]3[c:14]([cH:15][c:16]([CH2:18][N:39]4[CH:38]([CH3:42])[CH2:37][N:36]([C:29](=[O:30])[O:31][C:32]([CH3:33])([CH3:34])[CH3:35])[CH2:41][CH2:40]4)[cH:17]2)[N:13]([c:20]2[c:21]([Cl:27])[cH:22][cH:23][cH:24][c:25]2[Cl:26])[C:12](=[O:28])[NH:11][CH2:10]3)[cH:4][cH:5][cH:6][cH:7]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-21df855ca18a422588bff71870daa608
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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