HRID319337

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID962

Water

H2O

HCID8857

Ethyl acetate

C4H8O2

HCID28486

Lithium ion

Li+

HCID3280088

未命名化合物

HCID22145369

未命名化合物

结构：CC(=O)OC1NC(=O)C1C(CO[SiH](C)C)C(C)(C)C

HCID173232100

未命名化合物

PRODUCTS

生成物

结构：CCn1nc(C(=O)CC2NC(=O)C2C(CO[SiH](C)C)C(C)(C)C)cc1C

HCID178463146

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-dfc534ac5a124ba5944ffd902e19e399
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[C:1]([CH3:2])(=[O:3])[c:4]1[n:5][n:6]([CH2:10][CH3:11])[c:7]([CH3:9])[cH:8]1.[C:22]([O:23][CH:26]1[CH:27]([CH:31]([CH2:32][O:33][SiH:34]([CH3:35])[CH3:36])[C:37]([CH3:38])([CH3:39])[CH3:40])[C:28](=[O:30])[NH:29]1)(=[O:24])[CH3:25].[CH3:12][Si:13]([N-:14][Si:15]([CH3:16])([CH3:17])[CH3:18])([CH3:19])[CH3:20].[CH3:44][CH2:45][O:46][C:47](=[O:48])[CH3:49].[Cl-:41].[Li+:21].[NH4+:42].[OH2:43]>>[C:1]([CH2:2][CH:26]1[CH:27]([CH:31]([CH2:32][O:33][SiH:34]([CH3:35])[CH3:36])[C:37]([CH3:38])([CH3:39])[CH3:40])[C:28](=[O:30])[NH:29]1)(=[O:3])[c:4]1[n:5][n:6]([CH2:10][CH3:11])[c:7]([CH3:9])[cH:8]1