Sodium ion → HCID 178495164, compound

HRID 2131159Notes

Reaction equation

HRID 2131159 reaction equation
[CH2:5]([c:6]1[cH:7][cH:8][cH:9][cH:10][cH:11]1)[O:12][C:13](=[O:14])[N:15]1[CH2:16][CH:17]([O:47][CH2:48][c:49]2[cH:50][cH:51][c:52]3[c:53]([cH:63]2)[N:54]([CH2:58][CH2:59][CH2:60][O:61][CH3:62])[CH2:55][CH2:56][O:57]3)[CH:18]([c:33]2[cH:34][cH:35][c:36]([CH2:39][O:40][CH2:41][CH:42]([CH2:43][O:44][CH3:45])[CH3:46])[cH:37][cH:38]2)[CH:19]([CH2:21][O:22][S:23]([c:24]2[cH:25][cH:26][c:27]([CH3:28])[cH:29][cH:30]2)(=[O:31])=[O:32])[CH2:20]1.[CH3:64][N:65]1[CH2:66][CH2:67][CH2:68][N:69]([CH3:70])[C:71]1=[O:72].[CH3:73][O:74][C:75]([CH3:76])([CH3:77])[CH3:78].[N-:2]=[N+:3]=[N-:4].[Na+:1]>>[N:2](=[N+:3]=[N-:4])[CH2:21][CH:19]1[CH:18]([c:33]2[cH:34][cH:35][c:36]([CH2:39][O:40][CH2:41][CH:42]([CH2:43][O:44][CH3:45])[CH3:46])[cH:37][cH:38]2)[CH:17]([O:47][CH2:48][c:49]2[cH:50][cH:51][c:52]3[c:53]([cH:63]2)[N:54]([CH2:58][CH2:59][CH2:60][O:61][CH3:62])[CH2:55][CH2:56][O:57]3)[CH2:16][N:15]([C:13]([O:12][CH2:5][c:6]2[cH:7][cH:8][cH:9][cH:10][cH:11]2)=[O:14])[CH2:20]1

Participants

6

Reactant 5

HCID 923Sodium ionHCID 15413tert-Butyl methyl etherHCID 33558AzideHCID 816462(1H)-Pyrimidinone, tetrahydro-1,3-dimethyl-HCID 178495176HCID 178495176, compound

Product 1

HCID 178495164HCID 178495164, compound

Sources & evidence

ORD record
ord-c9b41ac31db547a795e161f16c951c92
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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