Dimethylcarbamoyl Chloride → N,N-dimethyl-3-[4-(4-n-propyl-2,6,7-trioxabicyclo[2,2,2]oct-1-yl)phenyl]-prop-2-ynthioamide

HRID 1571181Notes

Reaction equation

HRID 1571181 reaction equation
[C:1](#[CH:2])[c:3]1[cH:4][cH:5][c:6]([C:9]23[O:10][CH2:11][C:12]([CH2:17][CH2:18][CH3:19])([CH2:13][O:14]2)[CH2:15][O:16]3)[cH:7][cH:8]1.[CH3:20][N:21]([CH3:22])[C:23]([Cl:24])=[O:25].[CH3:26][N:27]([C:28](=[S:29])[Cl:30])[CH3:31]>>[C:1](#[C:2][C:28]([N:27]([CH3:26])[CH3:31])=[S:29])[c:3]1[cH:4][cH:5][c:6]([C:9]23[O:10][CH2:11][C:12]([CH2:17][CH2:18][CH3:19])([CH2:13][O:14]2)[CH2:15][O:16]3)[cH:7][cH:8]1

Participants

4

Reactant 3

HCID 6598Dimethylcarbamoyl ChlorideHCID 27871Dimethylthiocarbamoyl chlorideHCID 1152231-(4-Ethynylphenyl)-4-propyl-2,6,7-trioxabicyclo(2.2.2)octane

Product 1

HCID 15021992N,N-dimethyl-3-[4-(4-n-propyl-2,6,7-trioxabicyclo[2,2,2]oct-1-yl)phenyl]-prop-2-ynthioamide

Sources & evidence

ORD record
ord-7ebd907d4fc84a8cb764997fdcfebbeb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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