Water → HCID 23585426, compound

HRID 1134749Notes

Reaction equation

HRID 1134749 reaction equation
[CH2:1]1[N:2]([CH2:10][CH2:11][c:12]2[cH:13][c:14]([NH:22][C:23](=[O:24])[CH:25]3[CH2:26][CH2:27][c:28]4[cH:29][cH:30][c:31]([O:35][c:36]5[cH:37][c:38]([C:42](=[O:43])[NH:44][CH3:45])[n:39][cH:40][cH:41]5)[cH:32][c:33]4[CH2:34]3)[cH:15][c:16]([C:18]([F:19])([F:20])[F:21])[cH:17]2)[CH2:9][c:4]2[c:3]1[cH:8][cH:7][cH:6][cH:5]2.[CH3:50][CH2:51][O:52][C:53]([CH3:54])=[O:55].[NH2:46][CH2:47][CH2:48][NH2:49].[OH2:56]>>[NH2:2][CH2:10][CH2:11][c:12]1[cH:13][c:14]([NH:22][C:23](=[O:24])[CH:25]2[CH2:26][CH2:27][c:28]3[cH:29][cH:30][c:31]([O:35][c:36]4[cH:37][c:38]([C:42](=[O:43])[NH:44][CH3:45])[n:39][cH:40][cH:41]4)[cH:32][c:33]3[CH2:34]2)[cH:15][c:16]([C:18]([F:19])([F:20])[F:21])[cH:17]1

Participants

5

Reactant 4

HCID 962WaterHCID 3301EthylenediamineHCID 8857Ethyl AcetateHCID 66721518HCID 66721518, compound

Product 1

HCID 23585426HCID 23585426, compound

Sources & evidence

ORD record
ord-1ae919588b414bcd87eadbf161f03607
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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