HRID942304

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID81531

Diisopropylethylamine

C8H19N

结构：CC(C)(C(=O)Cl)c1cc(C(F)(F)F)cc(C(F)(F)F)c1

HCID11267141

未命名化合物

结构：CNc1cnc2c(cnn2Cc2ccccc2)c1-c1ccc(F)cc1C

HCID67441403

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(F)ccc1-c1c(N(C)C(=O)C(C)(C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cnc2c1cnn2Cc1ccccc1

HCID53496314

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-572d183fe084423e93c939241e08b258
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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