HRID98990

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID11776

Triphenylphosphine

C18H15P

4 次

HCID23938

Palladium

HCID14931784

未命名化合物

HCID21086179

Methyl 3-[(dipropylamino)carbonyl]-5-iodobenzoate

C15H20INO3

PRODUCTS

生成物

结构：CCCN(CCC)C(=O)c1cc(C(=O)OC)cc(-c2ncco2)c1

HCID21939658

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9ceafa443dfa429fb6a2adc8ed5fc40c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH2:13]([CH2:14][CH3:15])[N:16]([C:17](=[O:18])[c:19]1[cH:20][c:21]([C:22](=[O:23])[O:24][CH3:25])[cH:26][c:27]([I:29])[cH:28]1)[CH2:30][CH2:31][CH3:32].[CH2:1]([Sn:2]([CH2:3][CH3:9])([c:4]1[o:5][cH:6][cH:7][n:8]1)[CH2:10][CH3:11])[CH3:12].[CH3:33][N:34]([CH3:35])[CH:36]=[O:37].[Pd:114].[c:38]1([P:39]([c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)[cH:52][cH:53][cH:54][cH:55][cH:56]1.[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:95]1([P:96]([c:97]2[cH:98][cH:99][cH:100][cH:101][cH:102]2)[c:103]2[cH:104][cH:105][cH:106][cH:107][cH:108]2)[cH:109][cH:110][cH:111][cH:112][cH:113]1>>[c:4]1(-[c:27]2[cH:26][c:21]([C:22](=[O:23])[O:24][CH3:25])[cH:20][c:19]([C:17]([N:16]([CH2:13][CH2:14][CH3:15])[CH2:30][CH2:31][CH3:32])=[O:18])[cH:28]2)[o:5][cH:6][cH:7][n:8]1