HRID1119017

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID81531

Diisopropylethylamine

C8H19N

HCID521305

1-Chloroethyl carbonochloridate

C3H4Cl2O2

结构：CC(c1ccccc1)N1CCOC(C(Sc2ccccc2C(F)(F)F)c2ccccc2)C1

HCID178436072

未命名化合物

PRODUCTS

生成物

HCID17971814

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-aa0647fbc7664dc785b98bfb30f3b970
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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