Dimethyl Sulfoxide → 7-[3-(Dimethylamino)pyrrolidin-1-yl]-5-methyl-2-(2-methyl-1-phenylmethoxypropan-2-yl)-6-phenyl-1,3-benzoxazole-4-carbonitrile
Reaction equation
[CH2:20]([c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)[O:27][CH2:28][C:29]([CH3:30])([CH3:31])[c:32]1[o:33][c:34]2[c:35]([n:36]1)[c:37]([C:49]#[N:50])[c:38]([CH3:48])[c:39](-[c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1)[c:40]2[F:41].[CH3:16][S:17](=[O:18])[CH3:19].[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[CH3:51][CH2:52][O:53][C:54](=[O:55])[CH3:56].[CH3:8][N:9]([CH:10]1[CH2:11][NH:12][CH2:13][CH2:14]1)[CH3:15]>>[CH3:8][N:9]([CH:10]1[CH2:11][N:12]([c:40]2[c:34]3[o:33][c:32]([C:29]([CH2:28][O:27][CH2:20][c:21]4[cH:22][cH:23][cH:24][cH:25][cH:26]4)([CH3:30])[CH3:31])[n:36][c:35]3[c:37]([C:49]#[N:50])[c:38]([CH3:48])[c:39]2-[c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[CH2:13][CH2:14]1)[CH3:15]Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-de79e2051e5d4f46b500d5d3e065d8d3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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