Water → 2-[[4-(2,6-diphenylpyrimidin-4-yl)piperazin-1-yl]methyl]-2-methyl-6-nitro-3H-imidazo[2,1-b][1,3]oxazole
Reaction equation
[CH2:53]1[CH2:54][CH2:55][C:56]2=[N:61][CH2:60][CH2:59][CH2:58][N:57]2[CH2:62][CH2:63]1.[CH2:64]([Cl:65])[Cl:66].[CH3:1][C:2]1([CH2:13][N:14]2[CH2:15][CH2:16][N:17]([C:20]([O:21][C:22]([CH3:23])([CH3:24])[CH3:25])=[O:26])[CH2:18][CH2:19]2)[CH2:3][n:4]2[c:5]([n:7][c:8]([N+:10](=[O:11])[O-:12])[cH:9]2)[O:6]1.[Cl:34][c:35]1[n:36][c:37](-[c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)[n:38][c:39](-[c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[cH:40]1.[OH2:67].[OH:27][C:28]([C:29]([F:30])([F:31])[F:32])=[O:33]>>[CH3:1][C:2]1([CH2:13][N:14]2[CH2:15][CH2:16][N:17]([c:35]3[n:36][c:37](-[c:47]4[cH:48][cH:49][cH:50][cH:51][cH:52]4)[n:38][c:39](-[c:41]4[cH:42][cH:43][cH:44][cH:45][cH:46]4)[cH:40]3)[CH2:18][CH2:19]2)[CH2:3][n:4]2[c:5]([n:7][c:8]([N+:10](=[O:11])[O-:12])[cH:9]2)[O:6]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-ed4bbc482d004d2fad30f64285e54aeb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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