HRID310155

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6344

Dichloromethane

CH2Cl2

HCID2724942

未命名化合物

HCID11391618

2-methoxy-5-[5-(trifluoromethyl)tetrazol-1-yl]benzaldehyde

C10H7F3N4O2

结构：CC(C)(C)[Si](C)(C)OC1CC2CNCC(C(c3ccccc3)c3ccccc3)N2C1

HCID178455009

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(-n2nnnc2C(F)(F)F)cc1CN1CC2CC(O[Si](C)(C)C(C)(C)C)CN2C(C(c2ccccc2)c2ccccc2)C1

HCID22674522

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f98afb4d3c2c411e82518c11fe02bc84
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]([O:2][BH-:3]([O:4][C:5](=[O:6])[CH3:7])[O:8][C:9](=[O:10])[CH3:11])(=[O:12])[CH3:13].[CH3:45][O:46][c:47]1[c:48]([CH:49]=[O:50])[cH:51][c:52](-[n:55]2[n:56][n:57][n:58][c:59]2[C:60]([F:61])([F:62])[F:63])[cH:53][cH:54]1.[CH:15]([c:16]1[cH:17][cH:18][cH:19][cH:20][cH:21]1)([c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1)[CH:28]1[CH2:29][NH:30][CH2:31][CH:32]2[N:33]1[CH2:34][CH:35]([O:37][Si:38]([CH3:39])([CH3:40])[C:41]([CH3:42])([CH3:43])[CH3:44])[CH2:36]2.[Cl:64][CH2:65][Cl:66].[Na+:14]>>[CH:15]([c:16]1[cH:17][cH:18][cH:19][cH:20][cH:21]1)([c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1)[CH:28]1[CH2:29][N:30]([CH2:49][c:48]2[c:47]([O:46][CH3:45])[cH:54][cH:53][c:52](-[n:55]3[n:56][n:57][n:58][c:59]3[C:60]([F:61])([F:62])[F:63])[cH:51]2)[CH2:31][CH:32]2[N:33]1[CH2:34][CH:35]([O:37][Si:38]([CH3:39])([CH3:40])[C:41]([CH3:42])([CH3:43])[CH3:44])[CH2:36]2