Ammonia → (4-(2-(3-(Diethylamino)propylamino)quinazolin-4-ylamino)piperidin-1-yl)(2-nitrophenyl)methanone
Reaction equation
[CH2:1]([CH3:2])[N:3]([CH2:4][CH2:5][CH2:6][NH:7][c:8]1[n:9][c:10]2[cH:11][cH:12][cH:13][cH:14][c:15]2[c:16]([NH:18][CH:19]2[CH2:20][CH2:21][NH:22][CH2:23][CH2:24]2)[n:17]1)[CH2:25][CH3:26].[CH3:43][OH:44].[Cl:39][CH2:40][Cl:41].[N+:27](=[O:28])([O-:29])[c:30]1[c:31]([C:32](=[O:33])[Cl:34])[cH:35][cH:36][cH:37][cH:38]1.[NH3:42]>>[CH2:1]([CH3:2])[N:3]([CH2:4][CH2:5][CH2:6][NH:7][c:8]1[n:9][c:10]2[cH:11][cH:12][cH:13][cH:14][c:15]2[c:16]([NH:18][CH:19]2[CH2:20][CH2:21][N:22]([C:32]([c:31]3[c:30]([N+:27](=[O:28])[O-:29])[cH:38][cH:37][cH:36][cH:35]3)=[O:33])[CH2:23][CH2:24]2)[n:17]1)[CH2:25][CH3:26]Participants
6
Sources & evidence
- ORD record
- ord-aa4bc1c32dde40d081e553f85055f157
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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