Acetonitrile → HCID 54355381, compound

HRID 168644Notes

Reaction equation

HRID 168644 reaction equation
[CH3:16][N:17]=[C:18]=[O:19].[CH3:1][O:2][c:3]1[cH:4][c:5]([N:9]([NH2:10])[CH2:11][C:12](=[O:13])[O:14][CH3:15])[cH:6][cH:7][cH:8]1.[CH3:20][C:21]#[N:22]>>[CH3:1][O:2][c:3]1[cH:4][c:5]([N:9]([NH:10][C:18]([NH:17][CH3:16])=[O:19])[CH2:11][C:12](=[O:13])[O:14][CH3:15])[cH:6][cH:7][cH:8]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 12228Methyl IsocyanateHCID 53873990HCID 53873990, compound

Product 1

HCID 54355381HCID 54355381, compound

Sources & evidence

ORD record
ord-74085e023c444fe4a4d3897f17faa75b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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