Chloroform → HCID 23536931, compound

HRID 686648Notes

Reaction equation

[C:37]([CH3:38])([CH3:39])([CH3:40])[O:41][C:42](=[O:43])[N:44]1[CH2:45][CH2:46][NH:47][CH2:48][CH2:49]1.[CH:50]([Cl:51])([Cl:52])[Cl:53].[Cl:1][c:2]1[n:3][c:4]2[n:5]([CH2:29][O:30][C:31]([C:32]([CH3:33])([CH3:34])[CH3:35])=[O:36])[c:6](=[O:28])[n:7]([CH2:20][O:21][C:22]([C:23]([CH3:24])([CH3:25])[CH3:26])=[O:27])[c:8](=[O:19])[c:9]2[n:10]1-[c:11]1[c:12]([CH:17]=[O:18])[cH:13][cH:14][cH:15][cH:16]1>>[c:2]1([N:47]2[CH2:46][CH2:45][N:44]([C:42]([O:41][C:37]([CH3:38])([CH3:39])[CH3:40])=[O:43])[CH2:49][CH2:48]2)[n:3][c:4]2[n:5]([CH2:29][O:30][C:31]([C:32]([CH3:33])([CH3:34])[CH3:35])=[O:36])[c:6](=[O:28])[n:7]([CH2:20][O:21][C:22]([C:23]([CH3:24])([CH3:25])[CH3:26])=[O:27])[c:8](=[O:19])[c:9]2[n:10]1-[c:11]1[c:12]([CH:17]=[O:18])[cH:13][cH:14][cH:15][cH:16]1

Participants

Reactant 3

HCID 6212Chloroform

HCID 143452tert-Butyl piperazine-1-carboxylate

HCID 235368902,2-Dimethylpropionic acid [8-chloro-1-(2,2-dimethyl-propionyloxymethyl)-7-(2-formylphenyl)-2,6-dioxo-1,2,6,7-tetrahydropurin-3-yl]methyl ester

Product 1

HCID 23536931HCID 23536931, compound

Sources & evidence

ORD record: ord-dbb0e0a769e444fe829d3f5bd3e02a84
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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