Acetone → HCID 58754814, compound

HRID 2311258Notes

Reaction equation

HRID 2311258 reaction equation
[Br:1][c:2]1[cH:3][c:4]([C:26]2=[CH:27][CH2:28][CH2:29][CH2:30][CH2:31]2)[c:5]([NH:8][C:9](=[O:10])[c:11]2[n:12]([CH2:18][O:19][CH2:20][CH2:21][Si:22]([CH3:23])([CH3:24])[CH3:25])[cH:13][c:14]([C:16]#[N:17])[n:15]2)[cH:6][cH:7]1.[CH2:37]([Li:38])[CH2:39][CH2:40][CH3:41].[CH2:48]1[O:49][CH2:50][CH2:51][CH2:52]1.[CH3:42][C:43]([CH3:44])=[O:45].[CH3:53][CH2:54][O:55][C:56]([CH3:57])=[O:58].[CH:33]([Mg+:34])([CH3:35])[CH3:36].[Cl-:32].[Cl-:46].[NH4+:47]>>[Br:1][c:2]1[cH:3][c:4]([C:26]2=[CH:27][CH2:28][CH2:29][CH2:30][CH2:31]2)[c:5]([NH:8][C:9](=[O:10])[c:11]2[n:12]([CH2:18][O:19][CH2:20][CH2:21][Si:22]([CH3:23])([CH3:24])[CH3:25])[c:13]([C:43]([CH3:42])([CH3:44])[OH:45])[c:14]([C:16]#[N:17])[n:15]2)[cH:6][cH:7]1

Participants

9

Reactant 8

HCID 180AcetoneHCID 223AmmoniumHCID 312Chloride2×HCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 594575324-Cyano-1-(2-trimethylsilanyl-ethoxymethyl)-1H-imidazole-2-carboxylic acid (4-bromo-2-cyclohex-1-enyl-phenyl)-amideHCID 178418339ButyllithiumHCID 178461726HCID 178461726, compound

Product 1

HCID 58754814HCID 58754814, compound

Sources & evidence

ORD record
ord-ae1406b2dd9d4b6d897f648963b5b6f4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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