HRID159951

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID241

Benzene

C6H6

HCID8857

Ethyl acetate

C4H8O2

HCID11001043

2-(t-butyldiphenylsilyloxy)ethylamine

C18H25NOSi

HCID16682925

Aluminum, trimethyl-

C3H9Al

结构：CCOC(=O)c1csc(N2CC(C(C)(C)C)C2O[SiH](c2ccccc2)c2ccccc2)n1

HCID173183371

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)C1CN(c2nc(C(=O)NCCO[Si](c3ccccc3)(c3ccccc3)C(C)(C)C)cs2)C1O[SiH](c1ccccc1)c1ccccc1

HCID173183422

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-234e1d64a0a94c4badea5f10c519b482
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[CH:5]1[CH:6]([O:19][SiH:20]([c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[N:7]([c:9]2[s:10][cH:11][c:12]([C:14](=[O:15])[O:16][CH2:17][CH3:18])[n:13]2)[CH2:8]1.[C:37]([CH3:38])([CH3:39])([CH3:40])[Si:41]([O:42][CH2:43][CH2:44][NH2:45])([c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1)[c:52]1[cH:53][cH:54][cH:55][cH:56][cH:57]1.[CH3:33][Al:34]([CH3:35])[CH3:36].[CH3:58][C:59](=[O:60])[OH:61].[CH3:62][CH2:63][O:64][C:65](=[O:66])[CH3:67].[cH:68]1[cH:69][cH:70][cH:71][cH:72][cH:73]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[CH:5]1[CH:6]([O:19][SiH:20]([c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[N:7]([c:9]2[s:10][cH:11][c:12]([C:14](=[O:15])[NH:45][CH2:44][CH2:43][O:42][Si:41]([C:37]([CH3:38])([CH3:39])[CH3:40])([c:46]3[cH:47][cH:48][cH:49][cH:50][cH:51]3)[c:52]3[cH:53][cH:54][cH:55][cH:56][cH:57]3)[n:13]2)[CH2:8]1