Water → HCID 56681780, compound

HRID 2135410Notes

Reaction equation

HRID 2135410 reaction equation
[Br:42][CH2:43][CH2:44][Cl:45].[C:36](=[O:37])([O-:38])[O-:39].[CH3:1][N:2]1[CH2:3][CH2:4][N:5]([c:8]2[cH:9][cH:10][c:11]([O:31][C:32]([F:33])([F:34])[F:35])[c:12]([NH:14][c:15]3[n:16][c:17]4[c:22]([cH:23][n:24]3)[CH2:21][CH2:20][c:19]3[c:18]-4[nH:27][n:26][c:25]3[C:28](=[O:29])[NH2:30])[cH:13]2)[CH2:6][CH2:7]1.[Cs+:40].[Cs+:41].[O:47]=[CH:48][N:49]([CH3:50])[CH3:51].[OH2:46]>>[CH3:1][N:2]1[CH2:3][CH2:4][N:5]([c:8]2[cH:9][cH:10][c:11]([O:31][C:32]([F:33])([F:34])[F:35])[c:12]([NH:14][c:15]3[n:16][c:17]4[c:22]([cH:23][n:24]3)[CH2:21][CH2:20][c:19]3[c:18]-4[n:27]([CH2:43][CH2:44][Cl:45])[n:26][c:25]3[C:28](=[O:29])[NH2:30])[cH:13]2)[CH2:6][CH2:7]1

Participants

7

Reactant 6

HCID 962WaterHCID 6228DimethylformamideHCID 78491-Bromo-2-ChloroethaneHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 178480760HCID 178480760, compound

Product 1

HCID 56681780HCID 56681780, compound

Sources & evidence

ORD record
ord-1c59135a5cd943ca88c38fe02a90d829
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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