Tetrahydrofuran → HCID 66693276, compound

HRID 213689Notes

Reaction equation

HRID 213689 reaction equation
[CH3:1][O:2][CH2:3][CH:4]([O:5][c:6]1[cH:7][c:8]([O:9][c:10]2[cH:11][cH:12][c:13]([C:16](=[O:17])[OH:18])[n:14][cH:15]2)[cH:19][c:20](-[c:22]2[nH:23][c:24]([C:27]3=[N:31][CH2:30][CH:29]([CH3:32])[O:28]3)[cH:25][cH:26]2)[cH:21]1)[CH3:33].[CH3:34][N:35]1[CH2:36][CH2:37][NH:38][CH2:39][CH2:40]1.[CH:65]([N:66]([CH2:67][CH3:68])[CH:69]([CH3:70])[CH3:71])([CH3:72])[CH3:73].[O:74]1[CH2:75][CH2:76][CH2:77][CH2:78]1.[P-:41]([F:42])([F:43])([F:44])([F:45])([F:46])[F:47].[n:48]1([O:49][C:50]([N:51]([CH3:52])[CH3:53])=[N+:54]([CH3:55])[CH3:56])[c:57]2[n:58][cH:59][cH:60][cH:61][c:62]2[n:63][n:64]1>>[CH3:1][O:2][CH2:3][CH:4]([O:5][c:6]1[cH:7][c:8]([O:9][c:10]2[cH:11][cH:12][c:13]([C:16](=[O:17])[N:38]3[CH2:37][CH2:36][N:35]([CH3:34])[CH2:40][CH2:39]3)[n:14][cH:15]2)[cH:19][c:20](-[c:22]2[nH:23][c:24]([C:27]3=[N:31][CH2:30][CH:29]([CH3:32])[O:28]3)[cH:25][cH:26]2)[cH:21]1)[CH3:33]

Participants

7

Reactant 6

HCID 8028TetrahydrofuranHCID 9886HexafluorophosphateHCID 531671-MethylpiperazineHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 178495439HCID 178495439, compound

Product 1

HCID 66693276HCID 66693276, compound

Sources & evidence

ORD record
ord-81ce0a1df1c44a1f9e85efd3b5e0ecdf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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