Acetone → HCID 9818006, compound

HRID 1123674Notes

Reaction equation

HRID 1123674 reaction equation
[Br:1][CH2:2][CH:3]1[CH:4]([C:9](=[O:10])[NH:11][CH2:12][C:13]#[N:14])[CH2:5][CH2:6][CH2:7][CH2:8]1.[C:15](=[O:16])([O-:17])[O-:18].[CH3:29][C:30](=[O:31])[CH3:32].[Cs+:19].[Cs+:20].[F:21][c:22]1[cH:23][cH:24][c:25]([SH:28])[cH:26][cH:27]1>>[CH2:2]([CH:3]1[CH:4]([C:9](=[O:10])[NH:11][CH2:12][C:13]#[N:14])[CH2:5][CH2:6][CH2:7][CH2:8]1)[S:28][c:25]1[cH:24][cH:23][c:22]([F:21])[cH:27][cH:26]1

Participants

6

Reactant 5

HCID 180AcetoneHCID 19660Carbonate IonHCID 677894-FluorothiophenolHCID 104967Cesium cation2×HCID 86596153N-cyanomethyl 2-bromomethylcyclohexanecarboxamide

Product 1

HCID 9818006HCID 9818006, compound

Sources & evidence

ORD record
ord-72746079355d4cb0866dde2b0b00a1dd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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