Bicarbonate Ion → 1-(1-Benzylpyrrolidin-3-yl)-3-[4-(6,7-dimethoxyquinazolin-4-yl)oxy-2-nitrophenyl]urea
Reaction equation
[CH2:38]([c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1)[N:45]1[CH2:46][CH:47]([NH2:50])[CH2:48][CH2:49]1.[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([O:15][c:16]3[cH:17][c:18]([N+:23](=[O:24])[O-:25])[c:19]([NH2:20])[cH:21][cH:22]3)[n:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14].[CH3:56][CH2:57][N:58]([CH2:59][CH3:60])[CH2:61][CH3:62].[CH:63]([Cl:64])([Cl:65])[Cl:66].[Cl:26][C:27]([Cl:28])([O:29][C:30]([O:31][C:32]([Cl:33])([Cl:34])[Cl:35])=[O:36])[Cl:37].[Na+:51].[OH:52][C:53](=[O:54])[O-:55]>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([O:15][c:16]3[cH:17][c:18]([N+:23](=[O:24])[O-:25])[c:19]([NH:20][C:30](=[O:36])[NH:50][CH:47]4[CH2:46][N:45]([CH2:38][c:39]5[cH:40][cH:41][cH:42][cH:43][cH:44]5)[CH2:49][CH2:48]4)[cH:21][cH:22]3)[n:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14]Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-635d69ab2c2145aeadfc9ecdb38865aa
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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