1H-Indole-3-propanoic acid → {2-[3-[3-(1H-Indol-3-yl)-propyl]-3-(trans-4-methyl-cyclohexyl)-ureido]-thiazol-5-ylsulfanyl}-acetic acid
Reaction equation
[CH2:32]([O:33][C:34](=[O:35])[CH2:36][S:37][c:38]1[s:39][c:40]([NH2:41])[n:42][cH:43]1)[CH3:44].[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.[nH:45]1[cH:46][c:47]([CH2:54][CH2:55][C:56]([OH:57])=[O:58])[c:48]2[cH:49][cH:50][cH:51][cH:52][c:53]12>>[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)[c:47]1[cH:46][nH:45][c:53]2[c:48]1[cH:49][cH:50][cH:51][cH:52]2Participants
4
Reactant 3
Product 1
Sources & evidence
- ORD record
- ord-5f492a86bbb948019f6a1bfa5ccafc37
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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