Acetone → N,N-dimethyl-5-[[[2-(isothiocyanato)ethyl]thio]methyl]furanmethanamine

HRID 1217139Notes

Reaction equation

[CH3:18][CH2:19][N:20]([CH2:21][CH3:22])[CH2:23][CH3:24].[CH3:25][C:26](=[O:27])[CH3:28].[NH2:4][CH2:5][CH2:6][S:7][CH2:8][c:9]1[cH:10][cH:11][c:12]([CH2:14][N:15]([CH3:16])[CH3:17])[o:13]1.[S:1]=[C:2]=[S:3]>>[S:1]=[C:2]=[N:4][CH2:5][CH2:6][S:7][CH2:8][c:9]1[cH:10][cH:11][c:12]([CH2:14][N:15]([CH3:16])[CH3:17])[o:13]1

Participants

Reactant 4

HCID 180Acetone

HCID 6348Carbon Disulfide

HCID 8471Triethylamine

HCID 1622035-(((2-Aminoethyl)thio)methyl)-N,N-dimethyl-2-furanmethanamine

Product 1

HCID 20513971N,N-dimethyl-5-[[[2-(isothiocyanato)ethyl]thio]methyl]furanmethanamine

Sources & evidence

ORD record: ord-96753759f7994c6290f4d77685804d41
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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