HRID2323412

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID6344

Dichloromethane

CH2Cl2

HCID7397

p-Toluenesulfonyl chloride

C7H7ClO2S

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID19660

Carbonate

CO3-2

结构：CC(C)(C)N1C(=O)C(NCCCO)=C(c2ccccc2)S1(=O)=O

HCID11588111

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(S(=O)(=O)OCCCNC2=C(c3ccccc3)S(=O)(=O)N(C(C)(C)C)C2=O)cc1

HCID86625867

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3f5de98bdf184e929a0f9df041031294
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

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