Water → HCID 69656425, compound

HRID 89153

Reaction equation

HRID 89153 reaction equation
[C:28](=[O:29])([O-:30])[O-:31].[CH3:11][N:12]([C:13]([O:14][C:15]([CH3:16])([CH3:17])[CH3:18])=[O:19])[CH2:20][CH2:21][CH:22]([C:23]([F:24])([F:25])[F:26])[OH:27].[Cl:1][c:2]1[c:3]([C:4]#[N:5])[cH:6][cH:7][c:8]([CH3:10])[n:9]1.[Cs+:32].[Cs+:33].[O:34]=[CH:35][N:36]([CH3:37])[CH3:38].[OH2:39]>>[c:2]1([O:27][CH:22]([CH2:21][CH2:20][N:12]([CH3:11])[C:13]([O:14][C:15]([CH3:16])([CH3:17])[CH3:18])=[O:19])[C:23]([F:24])([F:25])[F:26])[c:3]([C:4]#[N:5])[cH:6][cH:7][c:8]([CH3:10])[n:9]1

Participants

7

Reactant 6

HCID 962WaterHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 5204002-Chloro-6-methylpyridine-3-carbonitrileHCID 21928363tert-butyl N-methyl-N-(4,4,4trifluoro-3-hydroxybutyl)carbamate

Product 1

HCID 69656425HCID 69656425, compound

Sources & evidence

ORD record
ord-2745d19651da46df8bcb9d77015f4504
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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