Dimethylformamide → 1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-2-(2-(methylthio)ethyl)-

Reaction equation

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

Participants

Reactant 3

HCID 6228Dimethylformamide

HCID 109652-Chloroethyl methyl sulfide

HCID 3380304,4-Dimethyl-1,3(2H,4H)-isoquinolinedione

Product 1

HCID 30534781,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-2-(2-(methylthio)ethyl)-

Sources & evidence

ORD record: ord-e140a4fb596a44518adbd9abe331c9fe
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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