Chloroform → (+/-)-{3-[[1-(3-Benzyl-4-oxo-3,4-dihydro-pyrrolo[2,1-f][1,2,4]triazin-2-yl)-propyl]-(4-chloro-benzoyl)-amino]-propyl}-carbamic acid tert-butyl ester
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH2:8][CH2:9][CH2:10][NH:11][CH:12]([CH2:13][CH3:14])[c:15]1[n:16][n:17]2[c:18]([c:19](=[O:28])[n:20]1[CH2:21][c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1)[cH:29][cH:30][cH:31]2)=[O:32].[CH3:43][CH2:44][N:45]([CH2:46][CH3:47])[CH2:48][CH3:49].[Cl:33][c:34]1[cH:35][cH:36][c:37]([C:38](=[O:39])[Cl:40])[cH:41][cH:42]1.[Cl:50][CH:51]([Cl:52])[Cl:53]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH2:8][CH2:9][CH2:10][N:11]([CH:12]([CH2:13][CH3:14])[c:15]1[n:16][n:17]2[c:18]([c:19](=[O:28])[n:20]1[CH2:21][c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1)[cH:29][cH:30][cH:31]2)[C:38]([c:37]1[cH:36][cH:35][c:34]([Cl:33])[cH:42][cH:41]1)=[O:39])=[O:32]Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-79227801fcb745b5b1918e35ca58a72c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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