Potassium Cation → 5-{[4-Cyano-1-(2-trimethylsilanyl-ethoxymethyl)-1H-imidazole-2-carbonyl]-amino}-6-(4,4-dimethyl-cyclohex-1-enyl)-3',4',5',6'-tetrahydro-2'H-[2,4']bipyridinyl-1'-carboxylic acid tert-butyl ester

HRID 2154937Notes

Reaction equation

HRID 2154937 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([c:14]2[n:15][c:16]([C:21]3=[CH:22][CH2:23][C:24]([CH3:27])([CH3:28])[CH2:25][CH2:26]3)[c:17]([NH2:20])[cH:18][cH:19]2)[CH2:12][CH2:13]1.[C:30](#[N:31])[c:32]1[n:33][c:34]([C:45](=[O:46])[O-:47])[n:35]([CH2:37][O:38][CH2:39][CH2:40][Si:41]([CH3:42])([CH3:43])[CH3:44])[cH:36]1.[CH:48]([N:49]([CH2:50][CH3:51])[CH:52]([CH3:53])[CH3:54])([CH3:55])[CH3:56].[Cl:57][CH2:58][Cl:59].[K+:29]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([c:14]2[n:15][c:16]([C:21]3=[CH:22][CH2:23][C:24]([CH3:27])([CH3:28])[CH2:25][CH2:26]3)[c:17]([NH:20][C:45]([c:34]3[n:33][c:32]([C:30]#[N:31])[cH:36][n:35]3[CH2:37][O:38][CH2:39][CH2:40][Si:41]([CH3:42])([CH3:43])[CH3:44])=[O:46])[cH:18][cH:19]2)[CH2:12][CH2:13]1

Participants

6

Reactant 5

HCID 813Potassium CationHCID 6344DichloromethaneHCID 81531DiisopropylethylamineHCID 591285844-Cyano-1-(2-trimethylsilylethoxymethyl)imidazole-2-carboxylateHCID 591286004-[5-Amino-6-(4,4-dimethyl-1-cyclohexen-1-yl)-2-pyridinyl]-1-piperidinecarboxylic acid 1,1-dimethylethyl ester

Product 1

HCID 591285565-{[4-Cyano-1-(2-trimethylsilanyl-ethoxymethyl)-1H-imidazole-2-carbonyl]-amino}-6-(4,4-dimethyl-cyclohex-1-enyl)-3',4',5',6'-tetrahydro-2'H-[2,4']bipyridinyl-1'-carboxylic acid tert-butyl ester

Sources & evidence

ORD record
ord-89ef37395e7040aeb6a19b1368073e77
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

Loading…