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Potassium Cation → tert-butyl N-[4-[[cyclobutyl-(3-fluorophenyl)methyl]carbamoyl]-8-fluoro-3-methyl-1-oxoisoquinolin-2-yl]-N-(3-fluoropropyl)carbamate

HRID 124426
Notes
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Reaction equation

HRID 124426 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][n:8]1[c:9](=[O:35])[c:10]2[c:11]([F:34])[cH:12][cH:13][cH:14][c:15]2[c:16]([C:19]([NH:20][CH:21]([c:22]2[cH:23][c:24]([F:28])[cH:25][cH:26][cH:27]2)[CH:29]2[CH2:30][CH2:31][CH2:32]2)=[O:33])[c:17]1[CH3:18])=[O:36].[CH3:37][c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1.[I:46][CH2:47][CH2:48][CH2:49][F:50].[K+:45].[OH-:44]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([N:7]([n:8]1[c:9](=[O:35])[c:10]2[c:11]([F:34])[cH:12][cH:13][cH:14][c:15]2[c:16]([C:19]([NH:20][CH:21]([c:22]2[cH:23][c:24]([F:28])[cH:25][cH:26][cH:27]2)[CH:29]2[CH2:30][CH2:31][CH2:32]2)=[O:33])[c:17]1[CH3:18])[CH2:47][CH2:48][CH2:49][F:50])=[O:36]
ParticipantsSources & evidenceReaction notes

Participants

6

Reactant 5

HCID 813Potassium CationHCID 961HydroxideHCID 1140TolueneHCID 128991281-Iodo-3-fluoropropaneHCID 67297921tert-butyl N-[4-[[cyclobutyl-(3-fluorophenyl)methyl]carbamoyl]-8-fluoro-3-methyl-1-oxoisoquinolin-2-yl]carbamate

Product 1

HCID 67304002
tert-butyl N-[4-[[cyclobutyl-(3-fluorophenyl)methyl]carbamoyl]-8-fluoro-3-methyl-1-oxoisoquinolin-2-yl]-N-(3-fluoropropyl)carbamate

Sources & evidence

ORD record
ord-3d96fd13c5d045d9b2e8c850e9ce5e01
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes