HRID2342810

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID7504

Benzylamine

C7H9N

HCID8471

Triethylamine

C6H15N

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID31297

Methanesulfonyl chloride

CH3ClO2S

结构：Cc1cc(F)ccc1C1C(OC(C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)OCC(CO)C1CO

HCID178427833

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(F)ccc1C1C(OC(C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)OCC2CN(Cc3ccccc3)CC21

HCID178427831

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-835c123878b54d4584cf52d06affeb27
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

[CH3:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42].[CH3:43][S:44](=[O:45])(=[O:46])[Cl:47].[CH3:56][N:57]([c:58]1[cH:59][cH:60][n:61][cH:62][cH:63]1)[CH3:64].[Cl:65][CH2:66][Cl:67].[F:1][C:2]([c:3]1[cH:4][c:5]([CH:13]([CH3:14])[O:15][CH:16]2[CH:17]([c:26]3[c:27]([CH3:33])[cH:28][c:29]([F:32])[cH:30][cH:31]3)[CH:18]([CH2:24][OH:25])[CH:19]([CH2:22][OH:23])[CH2:20][O:21]2)[cH:6][c:7]([C:9]([F:10])([F:11])[F:12])[cH:8]1)([F:34])[F:35].[NH2:48][CH2:49][c:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1>>[F:1][C:2]([c:3]1[cH:4][c:5]([CH:13]([CH3:14])[O:15][CH:16]2[CH:17]([c:26]3[c:27]([CH3:33])[cH:28][c:29]([F:32])[cH:30][cH:31]3)[CH:18]3[CH:19]([CH2:20][O:21]2)[CH2:22][N:48]([CH2:49][c:50]2[cH:51][cH:52][cH:53][cH:54][cH:55]2)[CH2:24]3)[cH:6][c:7]([C:9]([F:10])([F:11])[F:12])[cH:8]1)([F:34])[F:35]