1,2-Dichloroethane → Ethyl 4-[2-[[5-[2-[2-(cyclobutylcarbamoyl)pyrrolidin-1-yl]-2-oxoethoxy]-1-phenylpyrazole-3-carbonyl]amino]-6-phenylmethoxyhexanoyl]piperazine-1-carboxylate
Reaction equation
[CH2:50]([CH3:51])[O:52][C:53](=[O:54])[N:55]1[CH2:56][CH2:57][N:58]([C:61]([CH:62]([CH2:63][CH2:64][CH2:65][CH2:66][O:67][CH2:68][c:69]2[cH:70][cH:71][cH:72][cH:73][cH:74]2)[NH2:75])=[O:76])[CH2:59][CH2:60]1.[CH2:82]([Cl:83])[CH2:84][Cl:85].[CH:1]1([NH:5][C:6](=[O:7])[CH:8]2[N:9]([C:13]([CH2:14][O:15][c:16]3[cH:17][c:18]([C:27](=[O:28])[OH:29])[n:19][n:20]3-[c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)=[O:30])[CH2:10][CH2:11][CH2:12]2)[CH2:2][CH2:3][CH2:4]1.[CH:41]([N:42]([CH2:43][CH3:44])[CH:45]([CH3:46])[CH3:47])([CH3:48])[CH3:49].[O:77]=[CH:78][N:79]([CH3:80])[CH3:81].[OH:31][n:32]1[c:33]2[c:34]([cH:35][cH:36][cH:37][cH:38]2)[n:39][n:40]1>>[CH:1]1([NH:5][C:6](=[O:7])[CH:8]2[N:9]([C:13]([CH2:14][O:15][c:16]3[cH:17][c:18]([C:27](=[O:29])[NH:75][CH:62]([C:61]([N:58]4[CH2:57][CH2:56][N:55]([C:53]([O:52][CH2:50][CH3:51])=[O:54])[CH2:60][CH2:59]4)=[O:76])[CH2:63][CH2:64][CH2:65][CH2:66][O:67][CH2:68][c:69]4[cH:70][cH:71][cH:72][cH:73][cH:74]4)[n:19][n:20]3-[c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)=[O:30])[CH2:10][CH2:11][CH2:12]2)[CH2:2][CH2:3][CH2:4]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-4ca65207ba8f4fddb527e3667599a41f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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