Potassium Cation → 5-(5-(1-Acetyl-piperidin-4-yl)-2-{[4-cyano-1-(2-trimethylsilanyl-ethoxymethyl)-1H-imidazole-2-carbonyl]-amino}-phenyl)-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester

HRID 206574Notes

Reaction equation

HRID 206574 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:12]([c:14]2[c:15]([NH2:29])[cH:16][cH:17][c:18]([CH:20]3[CH2:21][CH2:22][N:23]([C:26]([CH3:27])=[O:28])[CH2:24][CH2:25]3)[cH:19]2)[CH2:13]1.[C:30](#[N:31])[c:32]1[n:33][c:34]([C:45](=[O:46])[OH:47])[n:35]([CH2:37][O:38][CH2:39][CH2:40][Si:41]([CH3:42])([CH3:43])[CH3:44])[cH:36]1.[C:49]([c:50]1[n:51][c:52]([C:53]([O-:54])=[O:55])[n:56]([CH2:57][O:58][CH2:59][CH2:60][Si:61]([CH3:62])([CH3:63])[CH3:64])[cH:65]1)#[N:66].[CH:67]([N:68]([CH2:69][CH3:70])[CH:71]([CH3:72])[CH3:73])([CH3:74])[CH3:75].[Cl:76][CH2:77][Cl:78].[K+:48]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]=[C:12]([c:14]2[c:15]([NH:29][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:16][cH:17][c:18]([CH:20]3[CH2:21][CH2:22][N:23]([C:26]([CH3:27])=[O:28])[CH2:24][CH2:25]3)[cH:19]2)[CH2:13]1

Participants

7

Reactant 6

HCID 813Potassium CationHCID 6344DichloromethaneHCID 81531DiisopropylethylamineHCID 591285815-[5-(1-Acetyl-piperidin-4-yl)-2-amino-phenyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl esterHCID 591285844-Cyano-1-(2-trimethylsilylethoxymethyl)imidazole-2-carboxylateHCID 591285854-Cyano-1-((2-(trimethylsilyl)ethoxy)methyl)-1H-imidazole-2-carboxylic acid

Product 1

HCID 591285915-(5-(1-Acetyl-piperidin-4-yl)-2-{[4-cyano-1-(2-trimethylsilanyl-ethoxymethyl)-1H-imidazole-2-carbonyl]-amino}-phenyl)-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester

Sources & evidence

ORD record
ord-1e65c4d0f1b340eda90e87840dfa0a6d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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