Acetonitrile → HCID 178436226, compound

HRID 95996Notes

Reaction equation

HRID 95996 reaction equation
[CH2:1]([CH3:2])[c:3]1[c:4]([N:11]=[C:12]2[N:13]([OH:17])[CH2:14][CH2:15][NH:16]2)[c:5]([CH2:9][CH3:10])[cH:6][cH:7][cH:8]1.[CH3:27][C:28]#[N:29].[Cl:18][CH2:19][c:20]1[n+:21]([O-:26])[cH:22][cH:23][cH:24][cH:25]1>>[CH2:1]([CH3:2])[c:3]1[c:4]([N:11]=[C:12]2[N:13]([O:17][CH2:19][c:20]3[n+:21]([O-:26])[cH:22][cH:23][cH:24][cH:25]3)[CH2:14][CH2:15][NH:16]2)[c:5]([CH2:9][CH3:10])[cH:6][cH:7][cH:8]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 2655032-(Chloromethyl)pyridine 1-oxideHCID 178436225HCID 178436225, compound

Product 1

HCID 178436226HCID 178436226, compound

Sources & evidence

ORD record
ord-65d599fd7cd94ec7b9254686cf63d04d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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