Potassium Cation → 3-[[5-(azetidine-1-carbonyl)-3-chloro-2-pyridinyl]oxy]-5-[1-[tert-butyl(dimethyl)silyl]oxypropan-2-yloxy]-N-(1-propan-2-ylpyrazol-3-yl)benzamide

HRID 112424

Reaction equation

HRID 112424 reaction equation
[C:45](=[O:46])([O-:47])[O-:48].[CH3:1][C:2]([CH3:3])([CH3:4])[Si:5]([O:6][CH2:7][CH:8]([CH3:9])[O:10][c:11]1[cH:12][c:13]([C:14](=[O:15])[NH:16][c:17]2[n:18][n:19]([CH:22]([CH3:23])[CH3:24])[cH:20][cH:21]2)[cH:25][c:26]([OH:28])[cH:27]1)([CH3:29])[CH3:30].[CH3:51][C:52]#[N:53].[K+:49].[K+:50].[N:31]1([C:35](=[O:36])[c:37]2[cH:38][c:39]([Cl:44])[c:40]([Cl:43])[n:41][cH:42]2)[CH2:32][CH2:33][CH2:34]1>>[CH3:1][C:2]([CH3:3])([CH3:4])[Si:5]([O:6][CH2:7][CH:8]([CH3:9])[O:10][c:11]1[cH:12][c:13]([C:14](=[O:15])[NH:16][c:17]2[n:18][n:19]([CH:22]([CH3:23])[CH3:24])[cH:20][cH:21]2)[cH:25][c:26]([O:28][c:40]2[c:39]([Cl:44])[cH:38][c:37]([C:35]([N:31]3[CH2:32][CH2:33][CH2:34]3)=[O:36])[cH:42][n:41]2)[cH:27]1)([CH3:29])[CH3:30]

Participants

6

Reactant 5

HCID 813Potassium Cation2×HCID 6342AcetonitrileHCID 19660Carbonate IonHCID 536296165-(Azetidin-1-ylcarbonyl)-2,3-dichloropyridineHCID 671097793-[1-[tert-butyl(dimethyl)silyl]oxypropan-2-yloxy]-5-hydroxy-N-(1-propan-2-ylpyrazol-3-yl)benzamide

Product 1

HCID 1784606453-[[5-(azetidine-1-carbonyl)-3-chloro-2-pyridinyl]oxy]-5-[1-[tert-butyl(dimethyl)silyl]oxypropan-2-yloxy]-N-(1-propan-2-ylpyrazol-3-yl)benzamide

Sources & evidence

ORD record
ord-a132ca45f812430cac7ca53afbbeb5a5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

Loading…