HRID2322163

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID19660

Carbonate

CO3-2

HCID53402948

5-Bromo-2-nitrothiophene-3-carboxamide

C5H3BrN2O3S

结构：CC(C)(O[Si](C)(C)C(C)(C)C)c1ccc(B2OC(C)(C)C(C)(C)O2)cn1

HCID59526189

未命名化合物

结构：c1ccc([PH](c2ccccc2)(c2ccccc2)[Pd]([PH](c2ccccc2)(c2ccccc2)c2ccccc2)([PH](c2ccccc2)(c2ccccc2)c2ccccc2)[PH](c2ccccc2)(c2ccccc2)c2ccccc2)cc1

HCID178420554

未命名化合物

PRODUCTS

生成物

结构：CC(C)(O[Si](C)(C)C(C)(C)C)c1ccc(-c2cc(C(N)=O)c([N+](=O)[O-])s2)cn1

HCID59525606

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3d1edea5a47040ed986fd342fd89c60a
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

[Br:1][c:2]1[cH:3][c:4]([C:10](=[O:11])[NH2:12])[c:5]([N+:7](=[O:8])[O-:9])[s:6]1.[C:13]([CH3:14])([CH3:15])([CH3:16])[Si:17]([O:18][C:19]([CH3:20])([CH3:21])[c:22]1[n:23][cH:24][c:25]([B:28]2[O:29][C:30]([CH3:31])([CH3:32])[C:33]([CH3:34])([CH3:35])[O:36]2)[cH:26][cH:27]1)([CH3:37])[CH3:38].[C:44](=[O:45])([O-:46])[O-:47].[CH2:39]1[O:40][CH2:41][CH2:42][CH2:43]1.[Na+:48].[Na+:49].[OH2:50].[cH:51]1[cH:52][cH:53][c:54]([P:55]([Pd:56]([P:57]([c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)([c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)[c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)([P:76]([c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)([c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)[c:89]2[cH:90][cH:91][cH:92][cH:93][cH:94]2)[P:95]([c:96]2[cH:97][cH:98][cH:99][cH:100][cH:101]2)([c:102]2[cH:103][cH:104][cH:105][cH:106][cH:107]2)[c:108]2[cH:109][cH:110][cH:111][cH:112][cH:113]2)([c:114]2[cH:115][cH:116][cH:117][cH:118][cH:119]2)[c:120]2[cH:121][cH:122][cH:123][cH:124][cH:125]2)[cH:126][cH:127]1>>[c:2]1(-[c:25]2[cH:24][n:23][c:22]([C:19]([O:18][Si:17]([C:13]([CH3:14])([CH3:15])[CH3:16])([CH3:37])[CH3:38])([CH3:20])[CH3:21])[cH:27][cH:26]2)[cH:3][c:4]([C:10](=[O:11])[NH2:12])[c:5]([N+:7](=[O:8])[O-:9])[s:6]1