HRID142475

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID23994

Zinc

HCID30165

Iodide ion

I-

HCID641024

tert-butyl (2-iodoethyl)carbamate

C7H14INO2

结构：C[Si](C)(C)CCN1C(=O)CN(c2ccc(I)cc2OCc2ccccc2)S1(=O)=O

HCID66756937

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NCCc1ccc(N2CC(=O)N(CC[Si](C)(C)C)S2(=O)=O)c(OCc2ccccc2)c1

HCID68842331

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8a319eeb6708478e8f8f3271a7028192
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH2:8][CH2:9][I:10])=[O:11].[CH2:13]([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[O:20][c:21]1[c:22]([N:28]2[CH2:29][C:30](=[O:41])[N:31]([CH2:35][CH2:36][Si:37]([CH3:38])([CH3:39])[CH3:40])[S:32]2(=[O:33])=[O:34])[cH:23][cH:24][c:25]([I:27])[cH:26]1.[CH3:47][CH2:48][O:49][C:50]([CH3:51])=[O:52].[I-:12].[O:42]=[CH:43][N:44]([CH3:45])[CH3:46].[Zn:53]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH2:8][CH2:9][c:25]1[cH:24][cH:23][c:22]([N:28]2[CH2:29][C:30](=[O:41])[N:31]([CH2:35][CH2:36][Si:37]([CH3:38])([CH3:39])[CH3:40])[S:32]2(=[O:33])=[O:34])[c:21]([O:20][CH2:13][c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[cH:26]1)=[O:11]