1,4-Dioxane → Cyclopropyl-[2-(2-isopropyl-2H-[1,2,4]triazol-3-yl)-4,5-dihydro-6-oxa-1,3a-diaza-benzo[e]azulen-8-yloxy]-acetic acid methyl ester
Reaction equation
[CH3:24][O:25][C:26]([CH:27]([OH:28])[CH:29]1[CH2:30][CH2:31]1)=[O:32].[CH:1]([CH3:2])([CH3:3])[n:4]1[n:5][cH:6][n:7][c:8]1-[c:9]1[n:10][c:11]2[n:12]([cH:23]1)[CH2:13][CH2:14][O:15][c:16]1[c:17]-2[cH:18][cH:19][c:20]([OH:22])[cH:21]1.[O:33]=[C:34]([O:35][CH:36]([CH3:37])[CH3:38])[N:39]=[N:40][C:41]([O:42][CH:43]([CH3:44])[CH3:45])=[O:46].[O:47]1[CH2:48][CH2:49][O:50][CH2:51][CH2:52]1>>[CH:1]([CH3:2])([CH3:3])[n:4]1[n:5][cH:6][n:7][c:8]1-[c:9]1[n:10][c:11]2[n:12]([cH:23]1)[CH2:13][CH2:14][O:15][c:16]1[c:17]-2[cH:18][cH:19][c:20]([O:22][CH:27]([C:26]([O:25][CH3:24])=[O:32])[CH:29]2[CH2:30][CH2:31]2)[cH:21]1Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-6176648541e24f6da963e25209f2c040
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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