Water → Ethyl 4-(2-(((4-(((8-(4-(2-butoxyethoxy)phenyl)-1-isobutyl-1,2,3,4-tetrahydro-1-benzazocine-5-yl)carbonyl)amino)phenyl)sulfanyl)methyl)-imidazol-1-yl)butanoate
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][CH2:6][CH2:7][O:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[cH:16][cH:17][c:18]3[c:19]([cH:33]2)[CH:20]=[C:21]([C:30](=[O:31])[OH:32])[CH2:22][CH2:23][CH2:24][N:25]3[CH2:26][CH:27]([CH3:28])[CH3:29])[cH:13][cH:14]1.[NH2:43][c:44]1[cH:45][cH:46][c:47]([S:50][CH2:51][c:52]2[n:53]([CH2:57][CH2:58][CH2:59][C:60](=[O:61])[O:62][CH2:63][CH3:64])[cH:54][cH:55][n:56]2)[cH:48][cH:49]1.[O:34]=[CH:35][N:36]([CH3:37])[CH3:38].[O:65]1[CH2:66][CH2:67][CH2:68][CH2:69]1.[OH2:76].[S:39]([Cl:40])([Cl:41])=[O:42].[cH:70]1[cH:71][cH:72][n:73][cH:74][cH:75]1>>[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][CH2:6][CH2:7][O:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[cH:16][cH:17][c:18]3[c:19]([cH:33]2)[CH:20]=[C:21]([C:30](=[O:31])[NH:43][c:44]2[cH:45][cH:46][c:47]([S:50][CH2:51][c:52]4[n:53]([CH2:57][CH2:58][CH2:59][C:60](=[O:61])[O:62][CH2:63][CH3:64])[cH:54][cH:55][n:56]4)[cH:48][cH:49]2)[CH2:22][CH2:23][CH2:24][N:25]3[CH2:26][CH:27]([CH3:28])[CH3:29])[cH:13][cH:14]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-d7d046b9fb7043b4828219dbd6605422
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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