tert-Butanol → 8-Bromo-4,5-dihydro-6-oxa-3-thia-1-aza-benzo[e]azulen-2-ylamine
Reaction equation
[Br:1][c:2]1[cH:3][c:4]2[c:5]([cH:17][cH:18]1)-[c:6]1[n:7][c:8]([C:14]([OH:15])=[O:16])[s:9][c:10]1[CH2:11][CH2:12][O:13]2.[CH3:19][CH2:20][N:21]([CH2:22][CH3:23])[CH2:24][CH3:25].[CH3:43][C:44]([OH:45])([CH3:46])[CH3:47].[c:26]1([P:27]([N:28]=[N+:29]=[N-:30])([c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)=[O:37])[cH:38][cH:39][cH:40][cH:41][cH:42]1>>[Br:1][c:2]1[cH:3][c:4]2[c:5]([cH:17][cH:18]1)-[c:6]1[n:7][c:8]([NH2:21])[s:9][c:10]1[CH2:11][CH2:12][O:13]2Participants
5
Sources & evidence
- ORD record
- ord-3db84d6db8864110a5f0e123eab76c3b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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