HRID1141020

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID8028

Tetrahydrofuran

C4H8O

HCID61163

4-(2-Hydroxyethyl)morpholine

C6H13NO2

HCID3280088

未命名化合物

结构：CC(C)(C)OC(=O)NC1CCN(c2cc(F)c(C#N)c(F)c2)CC1

HCID21090459

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NC1CCN(c2cc(F)c(C#N)c(OCCN3CCOCC3)c2)CC1

HCID59656697

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7cd7c005544148eabca3c1190fcb9d99
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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