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Water → 6-(6-chloropyrimidin-4-yl)oxy-N-[4-fluoro-3-(trifluoromethyl)phenyl]isoquinoline-1-carboxamide

HRID 2146574
Notes
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Reaction equation

HRID 2146574 reaction equation
[CH:34]([N:35]([CH:36]([CH3:37])[CH3:38])[CH2:39][CH3:40])([CH3:41])[CH3:42].[Cl:1][c:2]1[cH:3][c:4]([O:8][c:9]2[cH:10][c:11]3[cH:12][cH:13][n:14][c:15]([C:19](=[O:20])[Cl:21])[c:16]3[cH:17][cH:18]2)[n:5][cH:6][n:7]1.[Cl:44][CH2:45][Cl:46].[F:22][c:23]1[c:24]([C:30]([F:31])([F:32])[F:33])[cH:25][c:26]([NH2:27])[cH:28][cH:29]1.[OH2:43]>>[Cl:1][c:2]1[cH:3][c:4]([O:8][c:9]2[cH:10][c:11]3[cH:12][cH:13][n:14][c:15]([C:19](=[O:20])[NH:27][c:26]4[cH:25][c:24]([C:30]([F:31])([F:32])[F:33])[c:23]([F:22])[cH:29][cH:28]4)[c:16]3[cH:17][cH:18]2)[n:5][cH:6][n:7]1
ParticipantsSources & evidenceReaction notes

Participants

6

Reactant 5

HCID 962WaterHCID 6344DichloromethaneHCID 753774-Fluoro-3-(trifluoromethyl)anilineHCID 81531DiisopropylethylamineHCID 866386226-(6-Chloro-pyrimidin-4-yloxy)-isoquinoline-1-carbonyl chloride

Product 1

HCID 86624938
6-(6-chloropyrimidin-4-yl)oxy-N-[4-fluoro-3-(trifluoromethyl)phenyl]isoquinoline-1-carboxamide

Sources & evidence

ORD record
ord-3c0ec41fb7ac4863976347841a20015a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes