HRID671286

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

HCID23005377

(4-Chloro-3-methoxyphenyl)boronic acid

C7H8BClO3

HCID86652267

N-(7-chloro-2-methylpyrazolo[1,5-a]pyrimidin-5-yl)-4-(2-hydroxypropan-2-yl)benzamide

C17H17ClN4O2

PRODUCTS

产物

HCID67064366

N-(7-(4-chloro-3-methoxyphenyl)-2-methylpyrazolo[1,5-a]pyrimidin-5-yl)-4-(2-hydroxypropan-2-yl)benzamide

C24H23ClN4O3

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-a0cf5e9d52144310976f2ce664c3f775
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应SMILES

[CH3:42][OH:43].[Cl:1][c:2]1[cH:3][c:4]([NH:12][C:13]([c:14]2[cH:15][cH:16][c:17]([C:20]([CH3:21])([CH3:22])[OH:23])[cH:18][cH:19]2)=[O:24])[n:5][c:6]2[n:7]1[n:8][c:9]([CH3:11])[cH:10]2.[Cl:25][c:26]1[c:27]([O:35][CH3:36])[cH:28][c:29]([B:32]([OH:33])[OH:34])[cH:30][cH:31]1.[Na+:41].[O-:37][C:38]([OH:39])=[O:40]>>[c:2]1(-[c:29]2[cH:28][c:27]([O:35][CH3:36])[c:26]([Cl:25])[cH:31][cH:30]2)[cH:3][c:4]([NH:12][C:13]([c:14]2[cH:15][cH:16][c:17]([C:20]([CH3:21])([CH3:22])[OH:23])[cH:18][cH:19]2)=[O:24])[n:5][c:6]2[n:7]1[n:8][c:9]([CH3:11])[cH:10]2