1,4-Dioxane → 1-(4-(4-(4-(1,1,1,3,3,3-Hexafluoro-2-hydroxypropan-2-yl)benzyl)piperazine-1-carbonyl)-2-methoxyphenyl)-3-(pyridin-4-yl)urea
Reaction equation
[NH2:1][c:2]1[c:3]([O:33][CH3:34])[cH:4][c:5]([C:8](=[O:9])[N:10]2[CH2:11][CH2:12][N:13]([CH2:16][c:17]3[cH:18][cH:19][c:20]([C:23]([C:24]([F:25])([F:26])[F:27])([C:28]([F:29])([F:30])[F:31])[OH:32])[cH:21][cH:22]3)[CH2:14][CH2:15]2)[cH:6][cH:7]1.[O:51]1[CH2:52][CH2:53][O:54][CH2:55][CH2:56]1.[n:35]1[cH:36][cH:37][c:38]([NH:41][C:42]([O:43][c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)=[O:44])[cH:39][cH:40]1>>[NH:1]([c:2]1[c:3]([O:33][CH3:34])[cH:4][c:5]([C:8](=[O:9])[N:10]2[CH2:11][CH2:12][N:13]([CH2:16][c:17]3[cH:18][cH:19][c:20]([C:23]([C:24]([F:25])([F:26])[F:27])([C:28]([F:29])([F:30])[F:31])[OH:32])[cH:21][cH:22]3)[CH2:14][CH2:15]2)[cH:6][cH:7]1)[C:42]([NH:41][c:38]1[cH:37][cH:36][n:35][cH:40][cH:39]1)=[O:43]Participants
4
Reactant 3
Product 1
Sources & evidence
- ORD record
- ord-5918d5932a734a22a98cddcbd0b5b5e5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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