Water → HCID 66893244, compound

HRID 89807Notes

Reaction equation

HRID 89807 reaction equation
[CH3:29][CH2:30][N:31]([CH2:32][CH3:33])[CH2:34][CH3:35].[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[NH2:1][c:2]1[n:3][c:4]2[c:5]([c:6]3[cH:7][c:8]([CH2:12][CH2:13][c:14]4[c:15]([CH3:23])[cH:16][c:17]([C:18](=[O:19])[Cl:20])[cH:21][cH:22]4)[cH:9][n:10][c:11]13)[cH:24][cH:25][c:26]([CH3:28])[cH:27]2.[NH2:36][CH2:37][CH2:38][NH:39][C:40]([CH3:41])=[O:42].[OH2:49]>>[NH2:1][c:2]1[n:3][c:4]2[c:5]([c:6]3[cH:7][c:8]([CH2:12][CH2:13][c:14]4[c:15]([CH3:23])[cH:16][c:17]([C:18](=[O:19])[NH:36][CH2:37][CH2:38][NH:39][C:40]([CH3:41])=[O:42])[cH:21][cH:22]4)[cH:9][n:10][c:11]13)[cH:24][cH:25][c:26]([CH3:28])[cH:27]2

Participants

6

Reactant 5

HCID 962WaterHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 66082N-(2-aminoethyl)acetamideHCID 86652358HCID 86652358, compound

Product 1

HCID 66893244HCID 66893244, compound

Sources & evidence

ORD record
ord-fdd3882c873e4f77a2cc02249daa187c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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