Water → HCID 54279525, compound

HRID 111660Notes

Reaction equation

HRID 111660 reaction equation
[CH3:1][S:2]([O:3][CH2:6][CH2:7][CH:8]([CH2:9][C:10](=[O:11])[N:12]([c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1)[CH3:19])[c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1)(=[O:4])=[O:5].[CH3:39][CH2:40][N:41]([CH2:42][CH3:43])[CH2:44][CH3:45].[CH3:46][CH2:47][O:48][C:49]([CH3:50])=[O:51].[O:52]=[CH:53][N:54]([CH3:55])[CH3:56].[OH2:57].[c:26]1([CH2:32][N:33]2[CH2:34][CH2:35][NH:36][CH2:37][CH2:38]2)[cH:27][cH:28][cH:29][cH:30][cH:31]1>>[CH2:6]([CH2:7][CH:8]([CH2:9][C:10](=[O:11])[N:12]([c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1)[CH3:19])[c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1)[N:36]1[CH2:35][CH2:34][N:33]([CH2:32][c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[CH2:38][CH2:37]1

Participants

7

Reactant 6

HCID 962WaterHCID 6228DimethylformamideHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 759941-BenzylpiperazineHCID 19029360HCID 19029360, compound

Product 1

HCID 54279525HCID 54279525, compound

Sources & evidence

ORD record
ord-1328e5aec78644deb47fdc56b6cb8508
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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