Benzenepentanoic acid → {2-[3-(trans-4-Methyl-cyclohexyl)-3-(5-phenyl-pentyl)-ureido]-thiazol-5-ylsulfanyl}-acetic acid
Reaction equation
[CH2:45]([O:46][C:47](=[O:48])[CH2:49][S:50][c:51]1[s:52][c:53]([NH2:54])[n:55][cH:56]1)[CH3:57].[Cl:1][c:2]1[cH:3][c:4]([CH2:8][CH2:9][CH2:10][N:11]([C:12]([NH:13][c:14]2[s:15][c:16]([S:19][CH2:20][C:21](=[O:22])[OH:23])[cH:17][n:18]2)=[O:24])[CH:25]2[CH2:26][CH2:27][CH:28]([CH3:31])[CH2:29][CH2:30]2)[cH:5][cH:6][cH:7]1.[c:32]1([CH2:38][CH2:39][CH2:40][CH2:41][C:42]([OH:43])=[O:44])[cH:33][cH:34][cH:35][cH:36][cH:37]1>>[CH2:8]([CH2:9][CH2:10][N:11]([C:12]([NH:13][c:14]1[s:15][c:16]([S:19][CH2:20][C:21](=[O:22])[OH:23])[cH:17][n:18]1)=[O:24])[CH:25]1[CH2:26][CH2:27][CH:28]([CH3:31])[CH2:29][CH2:30]1)[CH2:39][CH2:38][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1Participants
4
Reactant 3
Product 1
Sources & evidence
- ORD record
- ord-6082bc383e014408a4f52024ea6b8fa6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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