Sodium ion → HCID 178514497, compound

HRID 86642Notes

Reaction equation

HRID 86642 reaction equation
[CH3:61][N:62]([CH3:63])[CH:64]=[O:65].[CH3:66][CH2:67][O:68][C:69](=[O:70])[CH3:71].[CH:1]1([CH2:7][N:8]2[CH2:9][CH:10]([CH2:14][NH:15][C:16](=[O:17])[CH:18]3[N:19]([C:23](=[O:24])[CH:25]4[N:26]([C:35]([CH2:36][C:37]([c:38]5[cH:39][cH:40][cH:41][cH:42][cH:43]5)([c:44]5[cH:45][cH:46][cH:47][cH:48][cH:49]5)[c:50]5[cH:51][cH:52][cH:53][cH:54][cH:55]5)=[O:56])[CH2:27][CH:28]([O:30][S:31]([CH3:32])(=[O:33])=[O:34])[CH2:29]4)[CH2:20][CH2:21][CH2:22]3)[CH2:11][CH2:12][CH2:13]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[N-:58]=[N+:59]=[N-:60].[Na+:57]>>[CH:1]1([CH2:7][N:8]2[CH2:9][CH:10]([CH2:14][NH:15][C:16](=[O:17])[CH:18]3[N:19]([C:23](=[O:24])[CH:25]4[N:26]([C:35]([CH2:36][C:37]([c:38]5[cH:39][cH:40][cH:41][cH:42][cH:43]5)([c:44]5[cH:45][cH:46][cH:47][cH:48][cH:49]5)[c:50]5[cH:51][cH:52][cH:53][cH:54][cH:55]5)=[O:56])[CH2:27][CH:28]([N:58]=[N+:59]=[N-:60])[CH2:29]4)[CH2:20][CH2:21][CH2:22]3)[CH2:11][CH2:12][CH2:13]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1

Participants

6

Reactant 5

HCID 923Sodium ionHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 33558AzideHCID 178505224HCID 178505224, compound

Product 1

HCID 178514497HCID 178514497, compound

Sources & evidence

ORD record
ord-8f0f5719e25e4372ae656123267286ca
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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