Acetonitrile → HCID 67860895, compound

HRID 2145069Notes

Reaction equation

HRID 2145069 reaction equation
[CH3:1][N:2]([CH3:3])[CH2:4][c:5]1[cH:6][cH:7][c:8]([CH2:10][S:11][CH2:12][CH2:13][NH2:14])[o:9]1.[CH3:41][C:42]#[N:43].[O:15]([c:16]1[cH:17][cH:18][cH:19][cH:20][cH:21]1)[C:22]([CH2:23][N+:24](=[O:25])[O-:26])([O:27][c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1)[O:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1>>[CH3:1][N:2]([CH3:3])[CH2:4][c:5]1[cH:6][cH:7][c:8]([CH2:10][S:11][CH2:12][CH2:13][NH:14][C:22]([O:15][c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)=[CH:23][N+:24](=[O:25])[O-:26])[o:9]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 1622035-(((2-Aminoethyl)thio)methyl)-N,N-dimethyl-2-furanmethanamineHCID 12509339HCID 12509339, compound

Product 1

HCID 67860895HCID 67860895, compound

Sources & evidence

ORD record
ord-33d32eda6096423eaed3805dca53538c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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