1,2-Dichloroethane → Butyl 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]([CH2:51][CH2:52][CH3:53])[O:54][C:55](=[O:56])[N:57]1[CH2:58][CH2:59][N:60]([C:63]([CH:64]([CH2:65][CH2:66][CH2:67][CH2:68][O:69][CH2:70][c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)[NH2:77])=[O:78])[CH2:61][CH2:62]1.[CH2:84]([Cl:85])[CH2:86][Cl:87].[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:79]=[CH:80][N:81]([CH3:82])[CH3:83].[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:28])[NH:77][CH:64]([C:63]([N:60]4[CH2:59][CH2:58][N:57]([C:55]([O:54][CH2:50][CH2:51][CH2:52][CH3:53])=[O:56])[CH2:62][CH2:61]4)=[O:78])[CH2:65][CH2:66][CH2:67][CH2:68][O:69][CH2:70][c:71]4[cH:72][cH:73][cH:74][cH:75][cH:76]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-e72dc397a6ed4ddd9c7999a511c79da1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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