HRID1210499

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID11776

Triphenylphosphine

C18H15P

2 次

HCID24290

未命名化合物

HCID24350

Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)

CuI

HCID11486936

未命名化合物

结构：C#CCCN(C(=O)OC(C)(C)C)S(=O)(=O)Cc1ccc(Cl)c(Cl)c1

HCID86603350

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N(CCC#Cc1cc(Cl)ccc1NC(c1ccccc1)c1ccccc1)S(=O)(=O)Cc1ccc(Cl)c(Cl)c1

HCID11643282

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-935a1f004a2b45528eb2df404a03db57
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[C:1](=[O:2])([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])[N:8]([S:9](=[O:10])(=[O:11])[CH2:12][c:13]1[cH:14][c:15]([Cl:20])[c:16]([Cl:19])[cH:17][cH:18]1)[CH2:21][CH2:22][C:23]#[CH:24].[CH3:47][CH2:48][N:49]([CH2:50][CH3:51])[CH2:52][CH3:53].[CH:25]([c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1)([c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1)[NH:38][c:39]1[c:40]([I:46])[cH:41][c:42]([Cl:45])[cH:43][cH:44]1.[Cu:95][I:96].[O:97]=[CH:98][N:99]([CH3:100])[CH3:101].[Pd:54]([Cl:55])[Cl:56].[c:57]1([P:58]([c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)[c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)[cH:71][cH:72][cH:73][cH:74][cH:75]1.[c:76]1([P:77]([c:78]2[cH:79][cH:80][cH:81][cH:82][cH:83]2)[c:84]2[cH:85][cH:86][cH:87][cH:88][cH:89]2)[cH:90][cH:91][cH:92][cH:93][cH:94]1>>[C:1](=[O:2])([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])[N:8]([S:9](=[O:10])(=[O:11])[CH2:12][c:13]1[cH:14][c:15]([Cl:20])[c:16]([Cl:19])[cH:17][cH:18]1)[CH2:21][CH2:22][C:23]#[C:24][c:40]1[c:39]([NH:38][CH:25]([c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[cH:44][cH:43][c:42]([Cl:45])[cH:41]1