HRID2160236

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID6344

Dichloromethane

CH2Cl2

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID18071892

3-Chloro-4-cyanobenzene-1-sulfonyl chloride

C7H3Cl2NO2S

HCID58408283

未命名化合物

PRODUCTS

生成物

结构：N#Cc1ccc(S(=O)(=O)N2CCc3cc(-c4ccc(C(F)(F)F)nc4)ccc32)cc1Cl

HCID58408276

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4b9e63b28aeb4d73a99ad6cff7766903
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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