HRID679553

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID7847

Acrolein

C3H4O

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID31297

Methanesulfonyl chloride

CH3ClO2S

HCID66111

Trimethylsilylacetylene

C5H10Si

HCID3782034

Trimethylammonium ion

C3H10N+

HCID19917033

5-(Trimethylsilyl)pent-1-en-4-yn-3-ol

C8H14OSi

HCID19917042

未命名化合物

HCID57280803

未命名化合物

PRODUCTS

生成物

结构：CCN(CC=CC#C[Si](C)(C)C)CCOCCOc1cccc(-c2ccsc2)c1

HCID54425872

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-043fd6d5b789478eac0c707cd2d6007a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[Br-:62].[Br:27][CH2:28][CH:29]=[CH:30][C:31]#[C:32][Si:33]([CH3:34])([CH3:35])[CH3:36].[C:21](=[O:22])([O-:23])[O-:24].[CH2:1]([CH3:2])[NH:3][CH2:4][CH2:5][O:6][CH2:7][CH2:8][O:9][c:10]1[cH:11][c:12](-[c:16]2[cH:17][s:18][cH:19][cH:20]2)[cH:13][cH:14][cH:15]1.[CH3:47][Si:48]([C:49]#[CH:50])([CH3:51])[CH3:52].[CH3:57][S:58](=[O:59])(=[O:60])[Cl:61].[CH3:63][NH+:64]([CH3:65])[CH3:66].[CH3:67][N:68]([CH3:69])[CH:70]=[O:71].[CH3:73][CH2:74][O:75][C:76](=[O:77])[CH3:78].[CH3:79][CH2:80][N:81]([CH2:82][CH3:83])[CH2:84][CH3:85].[CH:53]([CH:54]=[CH2:55])=[O:56].[K+:25].[K+:26].[OH2:72].[OH:37][CH:38]([CH:39]=[CH2:40])[C:41]#[C:42][Si:43]([CH3:44])([CH3:45])[CH3:46]>>[CH2:1]([CH3:2])[N:3]([CH2:4][CH2:5][O:6][CH2:7][CH2:8][O:9][c:10]1[cH:11][c:12](-[c:16]2[cH:17][s:18][cH:19][cH:20]2)[cH:13][cH:14][cH:15]1)[CH2:28][CH:29]=[CH:30][C:31]#[C:32][Si:33]([CH3:34])([CH3:35])[CH3:36]