Acetone → 4-(2-Methyl-[1,3]dioxolan-2-yl)-2-(3-nitro-pyrazol-1-ylmethyl)-thiazole
Reaction equation
[CH3:34][C:35](=[O:36])[CH3:37].[CH3:3][C:4]1([c:9]2[n:10][c:11]([CH2:14][O:15][S:16]([CH3:17])(=[O:18])=[O:19])[s:12][cH:13]2)[O:5][CH2:6][CH2:7][O:8]1.[K+:28].[K+:29].[N+:20](=[O:21])([O-:22])[c:23]1[cH:24][cH:25][n:26][nH:27]1.[N:1]#[N:2].[O-:30][C:31]([O-:32])=[O:33].[OH2:38]>>[CH3:3][C:4]1([c:9]2[n:10][c:11]([CH2:14][n:26]3[cH:25][cH:24][c:23]([N+:20](=[O:21])[O-:22])[n:27]3)[s:12][cH:13]2)[O:5][CH2:6][CH2:7][O:8]1Participants
8
Sources & evidence
- ORD record
- ord-ba4043bd5f4b4181a25d0cf45ab59fff
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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