HRID208018

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID26255

Tetrafluoroborate

BF4-

HCID81531

Diisopropylethylamine

C8H19N

HCID130500

未命名化合物

HCID19622689

未命名化合物

HCID59202039

未命名化合物

PRODUCTS

生成物

结构：C=CCOc1c(C)cc(C(=O)NNC(=O)c2ccc(CC(C)C)s2)cc1C

HCID66636951

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-be485373b30b4bfdbb061bc590855b19
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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