Toluene → HCID 23000214, compound

HRID 2162744Notes

Reaction equation

HRID 2162744 reaction equation
[Br:20][c:21]1[c:22](=[O:33])[n:23]([CH2:27][C:28](=[O:29])[O:30][CH2:31][CH3:32])[cH:24][cH:25][n:26]1.[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([NH2:19])[CH:11]([c:13]2[n:14][cH:15][cH:16][cH:17][cH:18]2)[CH2:12]1.[CH3:43][c:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1.[CH3:50][CH2:51][O:52][C:53]([CH3:54])=[O:55].[CH:34]([N:35]([CH2:36][CH3:37])[CH:38]([CH3:39])[CH3:40])([CH3:41])[CH3:42]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([NH:19][c:21]2[c:22](=[O:33])[n:23]([CH2:27][C:28](=[O:29])[O:30][CH2:31][CH3:32])[cH:24][cH:25][n:26]2)[CH:11]([c:13]2[n:14][cH:15][cH:16][cH:17][cH:18]2)[CH2:12]1

Participants

6

Reactant 5

HCID 1140TolueneHCID 8857Ethyl AcetateHCID 81531DiisopropylethylamineHCID 11807445(3-Bromo-2-oxo-2H-pyrazin-1-yl)-acetic Acid Ethyl EsterHCID 23000260HCID 23000260, compound

Product 1

HCID 23000214HCID 23000214, compound

Sources & evidence

ORD record
ord-e54f68d8c1f2474ea048ebef8f274bb0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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