HRID1539895

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID6325

Ethylene

C2H4

HCID6397

Chlorotrimethylsilane

C3H9ClSi

HCID7839

1,2-Dibromoethane

C2H4Br2

HCID8028

Tetrahydrofuran

C4H8O

HCID23994

Zinc

HCID521585

Tri(2-furyl)phosphine

C12H9O3P

HCID10923939

5-Iodo-1,3,6-trimethylpyrimidine-2,4(1H,3H)-dione

C7H9IN2O2

结构：COC(=O)C(Cc1ccc(I)c(C)c1)NC(=O)OCc1ccccc1

HCID22613738

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C(Cc1ccc(-c2c(C)n(C)c(=O)n(C)c2=O)c(C)c1)NC(=O)OCc1ccccc1

HCID22613761

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ef3ed3d0ba964ce9984828cd40a95cf7
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[Br:1][CH2:2][CH2:3][Br:4].[CH2:5]=[CH2:6].[CH2:67]1[O:68][CH2:69][CH2:70][CH2:71]1.[CH3:40][O:41][C:42]([CH:43]([NH:44][C:45](=[O:46])[O:47][CH2:48][c:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1)[CH2:55][c:56]1[cH:57][c:58]([CH3:63])[c:59]([I:62])[cH:60][cH:61]1)=[O:64].[CH3:7][Si:8]([CH3:9])([CH3:10])[Cl:11].[Cl-:65].[I:12][c:13]1[c:14](=[O:23])[n:15]([CH3:22])[c:16](=[O:21])[n:17]([CH3:20])[c:18]1[CH3:19].[NH4+:66].[Zn:72].[o:24]1[cH:25][cH:26][cH:27][c:28]1[P:29]([c:30]1[o:31][cH:32][cH:33][cH:34]1)[c:35]1[o:36][cH:37][cH:38][cH:39]1>>[c:13]1(-[c:59]2[c:58]([CH3:63])[cH:57][c:56]([CH2:55][CH:43]([C:42]([O:41][CH3:40])=[O:64])[NH:44][C:45](=[O:46])[O:47][CH2:48][c:49]3[cH:50][cH:51][cH:52][cH:53][cH:54]3)[cH:61][cH:60]2)[c:14](=[O:23])[n:15]([CH3:22])[c:16](=[O:21])[n:17]([CH3:20])[c:18]1[CH3:19]