Toluene → 4-[[5-(1-Ethoxycarbonylcyclobutyl)oxy-1-(3-methoxyphenyl)pyrazole-3-carbonyl]amino]-5-(4-ethoxycarbonylpiperazin-1-yl)-5-oxopentanoic acid
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[N:6]1[CH2:7][CH2:8][N:9]([C:12]([CH:13]([CH2:14][CH2:15][C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[NH:23][C:24](=[O:25])[c:26]2[n:27][n:28](-[c:41]3[cH:42][c:43]([O:47][CH3:48])[cH:44][cH:45][cH:46]3)[c:29]([O:31][C:32]3([C:36](=[O:37])[O:38][CH2:39][CH3:40])[CH2:33][CH2:34][CH2:35]3)[cH:30]2)=[O:49])[CH2:10][CH2:11]1.[CH3:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1.[Cl:57][CH2:58][Cl:59].[F:60][C:61]([F:62])([F:63])[C:64]([OH:65])=[O:66]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[N:6]1[CH2:7][CH2:8][N:9]([C:12]([CH:13]([CH2:14][CH2:15][C:16](=[O:17])[OH:18])[NH:23][C:24](=[O:25])[c:26]2[n:27][n:28](-[c:41]3[cH:42][c:43]([O:47][CH3:48])[cH:44][cH:45][cH:46]3)[c:29]([O:31][C:32]3([C:36](=[O:37])[O:38][CH2:39][CH3:40])[CH2:33][CH2:34][CH2:35]3)[cH:30]2)=[O:49])[CH2:10][CH2:11]1Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-cded61bafb7a4a50a65817db79b1ffe0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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