Water → HCID 58280058, compound

HRID 1556895Notes

Reaction equation

HRID 1556895 reaction equation
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6](-[c:9]2[c:10](-[c:30]3[cH:31][cH:32][cH:33][cH:34][cH:35]3)[o:11][c:12]3[n:13][cH:14][n:15][c:16]([NH:18][c:19]4[cH:20][c:21]([O:22][CH2:23][C:24](=[O:25])[NH2:26])[cH:27][cH:28][cH:29]4)[c:17]23)[cH:7][cH:8]1.[CH3:46][CH2:47][O:48][C:49](=[O:50])[CH3:51].[Cl:36][c:37]1[n:38][c:39]([Cl:40])[n:41][c:42]([Cl:43])[n:44]1.[O:52]=[CH:53][N:54]([CH3:55])[CH3:56].[OH2:45]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6](-[c:9]2[c:10](-[c:30]3[cH:31][cH:32][cH:33][cH:34][cH:35]3)[o:11][c:12]3[n:13][cH:14][n:15][c:16]([NH:18][c:19]4[cH:20][c:21]([O:22][CH2:23][C:24]#[N:26])[cH:27][cH:28][cH:29]4)[c:17]23)[cH:7][cH:8]1

Participants

6

Reactant 5

HCID 962WaterHCID 6228DimethylformamideHCID 7954Cyanuric chlorideHCID 8857Ethyl AcetateHCID 58280134HCID 58280134, compound

Product 1

HCID 58280058HCID 58280058, compound

Sources & evidence

ORD record
ord-cf7f16d3af0542759b70ccd38284ca9a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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