Acetonitrile → 8-Chloro-11-(4-nonyl-1-piperazinyl)dibenz[b,f][1,4]oxazepine
Reaction equation
[CH2:18]([CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH3:26])[N:27]1[CH2:28][CH2:29][NH:30][CH2:31][CH2:32]1.[CH3:44][C:45]#[N:46].[Cl:1][c:2]1[cH:3][c:4]2[c:5]([cH:16][cH:17]1)[O:6][c:7]1[c:8]([cH:12][cH:13][cH:14][cH:15]1)[C:9]([Cl:11])=[N:10]2.[N:33]12[CH2:34][CH2:35][CH2:36][N:37]=[C:38]1[CH2:39][CH2:40][CH2:41][CH2:42][CH2:43]2>>[Cl:1][c:2]1[cH:3][c:4]2[c:5]([cH:16][cH:17]1)[O:6][c:7]1[c:8]([cH:12][cH:13][cH:14][cH:15]1)[C:9]([N:30]1[CH2:29][CH2:28][N:27]([CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH3:26])[CH2:32][CH2:31]1)=[N:10]2Participants
5
Sources & evidence
- ORD record
- ord-2f06bc29cd894b01b40f4ac45877da1f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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