Potassium Cation → 4-Cyano-1-(2-trimethylsilanyl-ethoxymethyl)-1H-imidazole-2-carboxylic acid [2-cyclohex-1-enyl-4-(1,1-dioxo-hexahydro-1lambda6-thiopyran-4-yl)-phenyl]-amide

HRID 189044Notes

Reaction equation

HRID 189044 reaction equation
[Br:48][P+:49]([N:50]1[CH2:51][CH2:52][CH2:53][CH2:54]1)([N:55]1[CH2:56][CH2:57][CH2:58][CH2:59]1)[N:60]1[CH2:61][CH2:62][CH2:63][CH2:64]1.[C:1]1([c:7]2[c:8]([NH2:21])[cH:9][cH:10][c:11]([CH:13]3[CH2:14][CH2:15][S:16](=[O:19])(=[O:20])[CH2:17][CH2:18]3)[cH:12]2)=[CH:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[C:23](#[N:24])[c:25]1[n:26][c:27]([C:38](=[O:39])[O-:40])[n:28]([CH2:30][O:31][CH2:32][CH2:33][Si:34]([CH3:35])([CH3:36])[CH3:37])[cH:29]1.[CH3:79][CH2:80][O:81][C:82]([CH3:83])=[O:84].[CH:65]([N:66]([CH2:67][CH3:68])[CH:69]([CH3:70])[CH3:71])([CH3:72])[CH3:73].[K+:22].[O:74]=[CH:75][N:76]([CH3:77])[CH3:78].[P-:41]([F:42])([F:43])([F:44])([F:45])([F:46])[F:47]>>[C:1]1([c:7]2[c:8]([NH:21][C:38]([c:27]3[n:26][c:25]([C:23]#[N:24])[cH:29][n:28]3[CH2:30][O:31][CH2:32][CH2:33][Si:34]([CH3:35])([CH3:36])[CH3:37])=[O:39])[cH:9][cH:10][c:11]([CH:13]3[CH2:14][CH2:15][S:16](=[O:19])(=[O:20])[CH2:17][CH2:18]3)[cH:12]2)=[CH:2][CH2:3][CH2:4][CH2:5][CH2:6]1

Participants

9

Reactant 8

HCID 813Potassium CationHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 2733180Bromotripyrrolidin-1-ylphosphoniumHCID 591285412-Cyclohex-1-enyl-4-(1,1-dioxo-hexahydro-1lambda6-thiopyran-4-yl)-phenylamineHCID 591285844-Cyano-1-(2-trimethylsilylethoxymethyl)imidazole-2-carboxylate

Product 1

HCID 591285834-Cyano-1-(2-trimethylsilanyl-ethoxymethyl)-1H-imidazole-2-carboxylic acid [2-cyclohex-1-enyl-4-(1,1-dioxo-hexahydro-1lambda6-thiopyran-4-yl)-phenyl]-amide

Sources & evidence

ORD record
ord-68252470c6c543cea22150cbb020c1b0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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