Water → N-(3-fluoro-4-methylphenyl)-7-({2-[(methylamino)carbonyl]-pyridin-4-yl}oxy)-3,4-dihydroisoquinoline-2(1H)-carboxamide

HRID 188822Notes

Reaction equation

HRID 188822 reaction equation
[CH3:1][NH:2][C:3](=[O:4])[c:5]1[n:6][cH:7][cH:8][c:9]([O:11][c:12]2[cH:13][cH:14][c:15]3[c:20]([cH:21]2)[CH2:19][NH:18][CH2:17][CH2:16]3)[cH:10]1.[F:22][c:23]1[c:24]([CH3:32])[cH:25][cH:26][c:27]([N:29]=[C:30]=[O:31])[cH:28]1.[O:34]=[CH:35][N:36]([CH3:37])[CH3:38].[OH2:33]>>[CH3:1][NH:2][C:3](=[O:4])[c:5]1[n:6][cH:7][cH:8][c:9]([O:11][c:12]2[cH:13][cH:14][c:15]3[c:20]([cH:21]2)[CH2:19][N:18]([C:30]([NH:29][c:27]2[cH:26][cH:25][c:24]([CH3:32])[c:23]([F:22])[cH:28]2)=[O:31])[CH2:17][CH2:16]3)[cH:10]1

Participants

5

Reactant 4

HCID 962WaterHCID 6228DimethylformamideHCID 27373983-Fluoro-4-methylphenyl isocyanateHCID 58902413N-methyl-4-(1,2,3,4-tetrahydroisoquinolin-7-yloxy)pyridine-2-carboxamide

Product 1

HCID 58902290N-(3-fluoro-4-methylphenyl)-7-({2-[(methylamino)carbonyl]-pyridin-4-yl}oxy)-3,4-dihydroisoquinoline-2(1H)-carboxamide

Sources & evidence

ORD record
ord-4f3d58d86f024a73ae23a7311c14c802
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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