Acetonitrile → HCID 59542541, compound

HRID 672189Notes

Reaction equation

HRID 672189 reaction equation
[Br:1][c:2]1[cH:3][c:4]([C:7](=[O:8])[OH:9])[cH:5][s:6]1.[CH3:10][CH2:11][N:12]([CH2:13][CH3:14])[CH2:15][CH3:16].[CH3:17][C:18]1([CH3:24])[CH2:19][NH:20][CH2:21][CH2:22][CH2:23]1.[CH3:49][C:50]#[N:51].[P-:25]([F:26])([F:27])([F:28])([F:29])([F:30])[F:31].[n:32]1([O:33][C:34]([N:35]([CH3:36])[CH3:37])=[N+:38]([CH3:39])[CH3:40])[c:41]2[n:42][cH:43][cH:44][cH:45][c:46]2[n:47][n:48]1>>[Br:1][c:2]1[cH:3][c:4]([C:7](=[O:9])[N:20]2[CH2:19][C:18]([CH3:17])([CH3:24])[CH2:23][CH2:22][CH2:21]2)[cH:5][s:6]1

Participants

7

Reactant 6

HCID 6342AcetonitrileHCID 8471TriethylamineHCID 9886HexafluorophosphateHCID 709423,3-DimethylpiperidineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 120399785-Bromothiophene-3-carboxylic acid

Product 1

HCID 59542541HCID 59542541, compound

Sources & evidence

ORD record
ord-d4f41aebb37a43b5b2121b1fedfbec83
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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