Dimethylformamide → HCID 69937470, compound

HRID 1150543Notes

Reaction equation

HRID 1150543 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][N:9]=[CH:10][c:11]1[cH:12][c:13](-[c:17]2[s:18][cH:19][c:20](-[c:22]3[cH:23][c:24]([O:25][CH2:26][C:27](=[O:28])[OH:29])[cH:30][cH:31][cH:32]3)[n:21]2)[c:14]([CH3:16])[s:15]1.[C:43]([CH3:44])([CH3:45])([CH3:46])[O:47][C:48](=[O:49])[N:50]1[CH2:51][CH2:52][NH:53][CH2:54][CH2:55]1.[CH3:80][N:81]([CH3:82])[CH:83]=[O:84].[OH:33][c:34]1[c:35]2[n:36][n:37][nH:38][c:39]2[cH:40][cH:41][cH:42]1.[P-:56]([F:57])([F:58])([F:59])([F:60])([F:61])[F:62].[n:63]1([O:64][C:65]([N:66]([CH3:67])[CH3:68])=[N+:69]([CH3:70])[CH3:71])[c:72]2[n:73][cH:74][cH:75][cH:76][c:77]2[n:78][n:79]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][N:9]=[CH:10][c:11]1[cH:12][c:13](-[c:17]2[s:18][cH:19][c:20](-[c:22]3[cH:23][c:24]([O:25][CH2:26][C:27](=[O:28])[N:53]4[CH2:52][CH2:51][N:50]([C:48]([O:47][C:43]([CH3:44])([CH3:45])[CH3:46])=[O:49])[CH2:55][CH2:54]4)[cH:30][cH:31][cH:32]3)[n:21]2)[c:14]([CH3:16])[s:15]1

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 143452tert-Butyl piperazine-1-carboxylateHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 53716194HCID 53716194, compoundHCID 178418300HCID 178418300, compound

Product 1

HCID 69937470HCID 69937470, compound

Sources & evidence

ORD record
ord-294b685b064a4bc5acd8ed80399209af
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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