HRID803194

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID87976

2,6-Xylyl isothiocyanate

C9H9NS

HCID11138538

3-[3-(trifluoromethyl)phenoxy]azetidine

C10H10F3NO

结构：FC(F)(F)c1cccc(OC2CN(C(c3ccccc3)c3ccccc3)C2)c1

HCID11728694

未命名化合物

PRODUCTS

生成物

结构：Cc1cccc(C)c1NC(=S)N1CC(Oc2cccc(C(F)(F)F)c2)C1

HCID15053383

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0b377311c88b4de5b8f5b80bab7665ac
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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