Acetonitrile → 2-[[[5-(dimethylamino)methyl-2-furanyl]methyl]thio]ethyl-N'-(1-methylethyl)urea

HRID 96261Notes

Reaction equation

HRID 96261 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.[CH3:21][C:22]#[N:23].[CH:15]([CH3:16])([CH3:17])[N:18]=[C:19]=[O:20]>>[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:19]([NH:18][CH:15]([CH3:16])[CH3:17])=[O:20])[o:9]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 61277Isopropyl isocyanateHCID 1622035-(((2-Aminoethyl)thio)methyl)-N,N-dimethyl-2-furanmethanamine

Product 1

HCID 234521442-[[[5-(dimethylamino)methyl-2-furanyl]methyl]thio]ethyl-N'-(1-methylethyl)urea

Sources & evidence

ORD record
ord-c3abaeda59174ef48a4162d4294af06c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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