Water → HCID 66744445, compound

HRID 1135304Notes

Reaction equation

HRID 1135304 reaction equation
[CH2:32]1[CH2:33][NH:34][CH2:35][CH2:36][NH:37]1.[CH3:43][CH2:44][O:45][C:46]([CH3:47])=[O:48].[O:38]=[CH:39][N:40]([CH3:41])[CH3:42].[OH2:49].[s:1]1[c:2](-[c:10]2[c:11]([N:17]([C:18]([O:19][C:20]([CH3:21])([CH3:22])[CH3:23])=[O:24])[C:25](=[O:26])[O:27][C:28]([CH3:29])([CH3:30])[CH3:31])[n:12][cH:13][c:14]([Br:16])[n:15]2)[cH:3][c:4]2[c:5]1[cH:6][cH:7][cH:8][cH:9]2>>[s:1]1[c:2](-[c:10]2[c:11]([N:17]([C:18]([O:19][C:20]([CH3:21])([CH3:22])[CH3:23])=[O:24])[C:25](=[O:26])[O:27][C:28]([CH3:29])([CH3:30])[CH3:31])[n:12][cH:13][c:14]([N:34]3[CH2:33][CH2:32][NH:37][CH2:36][CH2:35]3)[n:15]2)[cH:3][c:4]2[c:5]1[cH:6][cH:7][cH:8][cH:9]2

Participants

6

Reactant 5

HCID 962WaterHCID 4837PiperazineHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 86662082HCID 86662082, compound

Product 1

HCID 66744445HCID 66744445, compound

Sources & evidence

ORD record
ord-c6d67472d211421ca729e7662a5f1d72
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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