Acetonitrile → 1-(2-Methoxy-5-(5-methylsulfonyl-1H-tetrazol-1-yl)benzoyl)-3-(2-(4-(1-(2-ethoxyethyl)-1H-benzimidazol-2-yl)[1,4]diazepan-1-yl)ethyl)-3-phenylpyrrolidine
Reaction equation
[CH2:46]([CH3:47])[O:48][CH2:49][CH2:50][n:51]1[c:52]([N:60]2[CH2:61][CH2:62][NH:63][CH2:64][CH2:65][CH2:66]2)[n:53][c:54]2[c:55]1[cH:56][cH:57][cH:58][cH:59]2.[CH3:1][O:2][c:3]1[c:4]([C:5](=[O:6])[N:7]2[CH2:8][C:9]([c:12]3[cH:13][cH:14][cH:15][cH:16][cH:17]3)([CH2:18][CH2:19][O:20][S:21]([CH3:22])(=[O:23])=[O:24])[CH2:10][CH2:11]2)[cH:25][c:26](-[n:29]2[n:30][n:31][n:32][c:33]2[S:34](=[O:35])(=[O:36])[CH3:37])[cH:27][cH:28]1.[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[CH3:67][C:68]#[N:69].[Cl:70][CH2:71][Cl:72].[IH:45]>>[CH3:1][O:2][c:3]1[c:4]([C:5](=[O:6])[N:7]2[CH2:8][C:9]([c:12]3[cH:13][cH:14][cH:15][cH:16][cH:17]3)([CH2:18][CH2:19][N:63]3[CH2:62][CH2:61][N:60]([c:52]4[n:51]([CH2:50][CH2:49][O:48][CH2:46][CH3:47])[c:55]5[c:54]([n:53]4)[cH:59][cH:58][cH:57][cH:56]5)[CH2:66][CH2:65][CH2:64]3)[CH2:10][CH2:11]2)[cH:25][c:26](-[n:29]2[n:30][n:31][n:32][c:33]2[S:34](=[O:35])(=[O:36])[CH3:37])[cH:27][cH:28]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-4cb65a642714420b828f58363ff08663
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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