Pyridine → 1-Methyl-1H-imidazole-4-sulfonic acid (4-chloro-benzyl)-(4,4-dimethyl-1-oxo-1,2,3,4-tetrahydro-isoquinolin-7-yl)-amide

HRID 2122520Notes

Reaction equation

HRID 2122520 reaction equation
[CH3:29][n:30]1[cH:31][n:32][c:33]([S:35](=[O:36])(=[O:37])[Cl:38])[cH:34]1.[CH3:39][C:40]#[N:41].[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][NH:7][c:8]2[cH:9][cH:10][c:11]3[c:16]([cH:17]2)[C:15](=[O:18])[NH:14][CH2:13][C:12]3([CH3:19])[CH3:20])[cH:21][cH:22]1.[cH:23]1[cH:24][cH:25][n:26][cH:27][cH:28]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][N:7]([c:8]2[cH:9][cH:10][c:11]3[c:16]([cH:17]2)[C:15](=[O:18])[NH:14][CH2:13][C:12]3([CH3:19])[CH3:20])[S:35]([c:33]2[n:32][cH:31][n:30]([CH3:29])[cH:34]2)(=[O:36])=[O:37])[cH:21][cH:22]1

Participants

5

Reactant 4

HCID 1049PyridineHCID 6342AcetonitrileHCID 27368871-methyl-1H-imidazole-4-sulfonyl chlorideHCID 67224204HCID 67224204, compound

Product 1

HCID 498345291-Methyl-1H-imidazole-4-sulfonic acid (4-chloro-benzyl)-(4,4-dimethyl-1-oxo-1,2,3,4-tetrahydro-isoquinolin-7-yl)-amide

Sources & evidence

ORD record
ord-830840188b5249b5941201bf25ed0d6e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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