HRID936058

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

HCID498716

未命名化合物

HCID2734686

(1-Ethoxycyclopropoxy)trimethylsilane

C8H18O2Si

结构：CNC(=O)C(NC(=O)c1nc(-c2ccccc2)n2c1CNCC2)C(C)(C)C

HCID66931907

未命名化合物

PRODUCTS

生成物

结构：CNC(=O)C(NC(=O)c1nc(-c2ccccc2)n2c1CN(C1CC1)CC2)C(C)(C)C

HCID66931876

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-eeecb266d6d84fedbd0a75ed2305f347
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:39]([BH3-:40])#[N:41].[CH2:28]([O:29][C:31]1([O:30][Si:34]([CH3:35])([CH3:36])[CH3:37])[CH2:32][CH2:33]1)[CH3:38].[CH3:1][C:2]([CH:3]([C:4](=[O:5])[NH:6][CH3:7])[NH:8][C:9](=[O:10])[c:11]1[n:12][c:13](-[c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[n:14]2[c:15]1[CH2:16][NH:17][CH2:18][CH2:19]2)([CH3:26])[CH3:27].[CH3:43][C:44](=[O:45])[OH:46].[CH3:47][OH:48].[Na+:42]>>[CH3:1][C:2]([CH:3]([C:4](=[O:5])[NH:6][CH3:7])[NH:8][C:9](=[O:10])[c:11]1[n:12][c:13](-[c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[n:14]2[c:15]1[CH2:16][N:17]([CH:31]1[CH2:32][CH2:33]1)[CH2:18][CH2:19]2)([CH3:26])[CH3:27]