HRID701250

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID6344

Dichloromethane

CH2Cl2

HCID6371

Phosgene

CCl2O

HCID7298

Cyclopentanol

C5H10O

HCID81531

Diisopropylethylamine

C8H19N

结构：CC(=O)N(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C1CCCNc2cc(Cl)ccc21

HCID59003177

未命名化合物

PRODUCTS

生成物

结构：CC(=O)N(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C1CCCN(C(=O)OC2CCCC2)c2cc(Cl)ccc21

HCID59003139

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a8c5fc13881b4a9b992a74981c8138f6
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

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