HRID161003

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID8071

未命名化合物

HCID11776

Triphenylphosphine

C18H15P

2 次

HCID19660

Carbonate

CO3-2

HCID24290

未命名化合物

结构：CC1(C)OB(c2cccc(S(N)(=O)=O)c2)OC1(C)C

HCID16414230

3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzene-1-sulfonamide

C12H18BNO4S

结构：O=C1Nc2ccccc2C12CC2c1ccc2c(I)n[nH]c2c1

HCID178517039

未命名化合物

PRODUCTS

生成物

结构：NS(=O)(=O)c1cccc(-c2n[nH]c3cc(C4CC45C(=O)Nc4ccccc45)ccc23)c1

HCID91482962

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e0590c69d8d64d46af0fe398d8f87eb5
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:42](=[O:43])([O-:44])[O-:45].[CH3:23][C:24]1([CH3:25])[C:26]([CH3:27])([CH3:28])[O:29][B:30]([c:31]2[cH:32][c:33]([S:37](=[O:38])(=[O:39])[NH2:40])[cH:34][cH:35][cH:36]2)[O:41]1.[CH3:48][O:49][CH2:50][CH2:51][O:52][CH3:53].[I:1][c:2]1[n:3][nH:4][c:5]2[cH:6][c:7]([CH:11]3[C:12]4([CH2:13]3)[C:14](=[O:22])[NH:15][c:16]3[cH:17][cH:18][cH:19][cH:20][c:21]34)[cH:8][cH:9][c:10]12.[Na+:46].[Na+:47].[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:2]1(-[c:31]2[cH:32][c:33]([S:37](=[O:38])(=[O:39])[NH2:40])[cH:34][cH:35][cH:36]2)[n:3][nH:4][c:5]2[cH:6][c:7]([CH:11]3[C:12]4([CH2:13]3)[C:14](=[O:22])[NH:15][c:16]3[cH:17][cH:18][cH:19][cH:20][c:21]34)[cH:8][cH:9][c:10]12