{1-[5-(4'-{2-[1-(2-Methoxycarbonylamino-3-methyl-butyryl)-pyrrolidin-2-yl]-3H-imidazol-4-yl}-biphenyl-4-yl)-1H-imidazol-2-ylmethyl]-2-oxo-piperidin-3-yl]-carbamic acid tert-butyl ester → [1-(2-{5-[4'-(2-Amino-acetyl)-biphenyl-4-yl]-1H-imidazol-2-yl}-pyrrolidine-1-carbonyl)-2-methyl-propyl]-carbamic acid methyl ester
Reaction equation
[C:45]([O:46][C:47](=[O:48])[NH:49][CH:50]1[CH2:51][CH2:52][CH2:53][N:54]([CH2:55][c:56]2[nH:57][c:58](-[c:59]3[cH:60][cH:61][c:62](-[c:63]4[cH:64][cH:65][c:66](-[c:67]5[nH:68][c:69]([CH:70]6[CH2:71][CH2:72][CH2:73][N:74]6[C:75](=[O:76])[CH:77]([NH:78][C:79]([O:80][CH3:81])=[O:82])[CH:83]([CH3:84])[CH3:85])[n:86][cH:87]5)[cH:88][cH:89]4)[cH:90][cH:91]3)[cH:92][n:93]2)[C:94]1=[O:95])([CH3:96])([CH3:97])[CH3:98].[CH3:1][O:2][C:3]([NH:4][CH:5]([CH:6]([CH3:7])[CH3:8])[C:9](=[O:10])[N:11]1[CH:12]([c:16]2[nH:17][c:18](-[c:21]3[cH:22][cH:23][c:24](-[c:27]4[cH:28][cH:29][c:30]([C:33]([CH2:34][NH:35][C:36]([O:37][C:38]([CH3:39])([CH3:40])[CH3:41])=[O:42])=[O:43])[cH:31][cH:32]4)[cH:25][cH:26]3)[cH:19][n:20]2)[CH2:13][CH2:14][CH2:15]1)=[O:44]>>[CH3:1][O:2][C:3]([NH:4][CH:5]([CH:6]([CH3:7])[CH3:8])[C:9](=[O:10])[N:11]1[CH:12]([c:16]2[nH:17][c:18](-[c:21]3[cH:22][cH:23][c:24](-[c:27]4[cH:28][cH:29][c:30]([C:33]([CH2:34][NH2:35])=[O:43])[cH:31][cH:32]4)[cH:25][cH:26]3)[cH:19][n:20]2)[CH2:13][CH2:14][CH2:15]1)=[O:44]Participants
3
Reactant 2
HCID 66620320{1-[5-(4'-{2-[1-(2-Methoxycarbonylamino-3-methyl-butyryl)-pyrrolidin-2-yl]-3H-imidazol-4-yl}-biphenyl-4-yl)-1H-imidazol-2-ylmethyl]-2-oxo-piperidin-3-yl]-carbamic acid tert-butyl ester
HCID 66620939[1-(2-{5-[4'-(2-tert-butoxycarbonylamino-acetyl)-biphenyl-4-yl]-1H-imidazol-2-yl]-pyrrolidine-1-carbonyl)-2-methyl-propyl]-carbamic acid methyl esterProduct 1
Sources & evidence
- ORD record
- ord-ffbaa2ddd1384dedb8bb1177adfa90ef
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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