Water → 8-Azetidin-3-yl-2-(2-isopropyl-5-methyl-2H-[1,2,4]triazol-3-yl)-4,5-dihydro-6-oxa-3-thia-1-aza-benzo[e]azulene
Reaction equation
[C:1]([O:2][C:3](=[O:4])[N:8]1[CH2:9][CH:10]([c:12]2[cH:13][c:14]3[c:15]([cH:33][cH:34]2)-[c:16]2[n:17][c:18](-[c:24]4[n:25]([CH:30]([CH3:31])[CH3:32])[n:26][c:27]([CH3:29])[n:28]4)[s:19][c:20]2[CH2:21][CH2:22][O:23]3)[CH2:11]1)([CH3:5])([CH3:6])[CH3:7].[CH2:49]([Cl:50])[Cl:51].[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[OH2:42].[OH:35][C:36]([C:37]([F:38])([F:39])[F:40])=[O:41]>>[NH:8]1[CH2:9][CH:10]([c:12]2[cH:13][c:14]3[c:15]([cH:33][cH:34]2)-[c:16]2[n:17][c:18](-[c:24]4[n:25]([CH:30]([CH3:31])[CH3:32])[n:26][c:27]([CH3:29])[n:28]4)[s:19][c:20]2[CH2:21][CH2:22][O:23]3)[CH2:11]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-9302ef61046841b6a85122ad9409a5be
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
Loading…