HRID1552255

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID6386

tert-Butyl alcohol

C4H10O

HCID4574913

未命名化合物

HCID12364230

6-Chloro-N-methylpyridine-3-carboxamide

C7H7ClN2O

HCID18173274

未命名化合物

PRODUCTS

生成物

结构：CNC(=O)c1ccc(Oc2ccc3c(c2)CCN(C(=O)OC(C)(C)C)CC3)nc1

HCID59257928

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-65aeabea6cac41d99338b11afaf10ad3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][c:11]2[c:12]([cH:15][c:16]([OH:19])[cH:17][cH:18]2)[CH2:13][CH2:14]1.[CH3:20][C:21]([CH3:22])([O-:23])[CH3:24].[CH3:37][C:38]([OH:39])([CH3:40])[CH3:41].[Cl:26][c:27]1[n:28][cH:29][c:30]([C:31](=[O:32])[NH:33][CH3:34])[cH:35][cH:36]1.[K+:25]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][c:11]2[c:12]([cH:15][c:16]([O:19][c:27]3[n:28][cH:29][c:30]([C:31](=[O:32])[NH:33][CH3:34])[cH:35][cH:36]3)[cH:17][cH:18]2)[CH2:13][CH2:14]1