Dimethylformamide → Chloride

HRID 694686Notes

Reaction equation

HRID 694686 reaction equation
[CH3:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][cH:10][c:11]3[c:16]([cH:17]2)[CH2:15][N:14]([C:18](=[O:19])[NH:20][c:21]2[cH:22][cH:23][c:24]([CH2:25][Cl:26])[cH:27][cH:28]2)[CH2:13][CH2:12]3)[cH:6][cH:7]1.[CH3:29][CH2:30][N:31]1[CH2:32][CH2:33][CH2:34][CH2:35][CH2:36]1.[CH3:37][N:38]([CH3:39])[CH:40]=[O:41]>>[CH3:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][cH:10][c:11]3[c:16]([cH:17]2)[CH2:15][N:14]([C:18](=[O:19])[NH:20][c:21]2[cH:22][cH:23][c:24]([CH2:25][N+:31]4([CH2:30][CH3:29])[CH2:32][CH2:33][CH2:34][CH2:35][CH2:36]4)[cH:27][cH:28]2)[CH2:13][CH2:12]3)[cH:6][cH:7]1.[Cl-:26]

Participants

5

Reactant 3

HCID 6228DimethylformamideHCID 13007N-EthylpiperidineHCID 229900814-(7-(4-Methylphenyl)-1,2,3,4-tetrahydroisoquinolin-2-ylcarbonylamino)benzyl chloride

Product 2

HCID 312ChlorideHCID 22990086N-[4-[(1-ethylpiperidin-1-ium-1-yl)methyl]phenyl]-7-(4-methylphenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide

Sources & evidence

ORD record
ord-8ceadd4aa3c44df79c4759b3740dca46
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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