HRID2325874

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8857

Ethyl acetate

C4H8O2

HCID24814

Antimony trichloride

Cl3Sb

HCID2734690

Sulfur, trifluoro[2-methoxy-N-(2-methoxyethyl)ethanaminato-.kappa.N]-, (T-4)-

C6H14F3NO2S

结构：CSc1ccc(-c2coc3ccc(-c4nnc(C)o4)cc23)cc1

HCID44481756

未命名化合物

PRODUCTS

生成物

结构：Cc1nnc(-c2ccc3occ(-c4ccc(SCF)cc4)c3c2)o1

HCID68663962

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1e38bfbd012f48b89f40a65aa97c5849
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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