Acetate → 4'-[[(2,6-Dichloro-4-quinazolinyl)amino]methyl][1,1'-biphenyl]-2-carboxylic acid
Reaction equation
[CH2:36]1[O:37][CH2:38][CH2:39][CH2:40]1.[CH3:2][C:3](=[O:4])[O-:5].[Cl:6][c:7]1[n:8][c:9]2[cH:10][cH:11][c:12]([Cl:18])[cH:13][c:14]2[c:15]([Cl:17])[n:16]1.[NH2:19][CH2:20][c:21]1[cH:22][cH:23][c:24](-[c:27]2[c:28]([C:33](=[O:34])[OH:35])[cH:29][cH:30][cH:31][cH:32]2)[cH:25][cH:26]1.[Na+:1]>>[Cl:6][c:7]1[n:8][c:9]2[cH:10][cH:11][c:12]([Cl:18])[cH:13][c:14]2[c:15]([NH:19][CH2:20][c:21]2[cH:22][cH:23][c:24](-[c:27]3[c:28]([C:33](=[O:34])[OH:35])[cH:29][cH:30][cH:31][cH:32]3)[cH:25][cH:26]2)[n:16]1Participants
6
Sources & evidence
- ORD record
- ord-2fe49c319da84990914f64278efe5086
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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