Acetonitrile → HCID 86626176, compound

HRID 313685Notes

Reaction equation

HRID 313685 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]2[c:12]([NH:22][CH2:23][C:24]([CH3:25])([CH3:26])[NH:27][C:28]([O:29][C:30]([CH3:31])([CH3:32])[CH3:33])=[O:34])[c:13]([N+:19]([O-:20])=[O:21])[cH:14][n:15][c:16]2[cH:17][cH:18]1.[CH3:37][C:38]#[N:39].[H:35][H:36]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]2[c:12]([NH:22][CH2:23][C:24]([CH3:25])([CH3:26])[NH:27][C:28]([O:29][C:30]([CH3:31])([CH3:32])[CH3:33])=[O:34])[c:13]([NH2:19])[cH:14][n:15][c:16]2[cH:17][cH:18]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 86626175HCID 86626175, compoundHCID 178418361HCID 178418361, compound

Product 1

HCID 86626176HCID 86626176, compound

Sources & evidence

ORD record
ord-f44889b8e7734340ab83e567335e8ffb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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