HRID2148379

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2757146

Benzene, 1-bromo-3-(methylsulfonyl)-

C7H7BrO2S

结构：c1ccc(P(C2CCCCC2)C2CCCCC2)c(-c2ccccc2P(C2CCCCC2)C2CCCCC2)c1

HCID24946987

([1,1'-Biphenyl]-2,2'-diyl)bis(dicyclohexylphosphane)

C36H52P2

结构：CS(=O)(=O)c1ccc(-c2cccn3nc(N)nc23)cc1

HCID57502376

未命名化合物

PRODUCTS

生成物

结构：CS(=O)(=O)c1ccc(-c2cccn3nc(Nc4cccc(S(C)(=O)=O)c4)nc23)cc1

HCID57514091

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-df6f6a6e8211430aab3927e627b70f16
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[Br:21][c:22]1[cH:23][c:24]([S:28](=[O:29])(=[O:30])[CH3:31])[cH:25][cH:26][cH:27]1.[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8](-[c:11]2[c:12]3[n:13]([cH:14][cH:15][cH:16]2)[n:17][c:18]([NH2:20])[n:19]3)[cH:9][cH:10]1.[CH:32]1([P:33]([CH:34]2[CH2:35][CH2:36][CH2:37][CH2:38][CH2:39]2)[c:40]2[cH:41][cH:42][cH:43][cH:44][c:45]2-[c:46]2[cH:47][cH:48][cH:49][cH:50][c:51]2[P:52]([CH:53]2[CH2:54][CH2:55][CH2:56][CH2:57][CH2:58]2)[CH:59]2[CH2:60][CH2:61][CH2:62][CH2:63][CH2:64]2)[CH2:65][CH2:66][CH2:67][CH2:68][CH2:69]1>>[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8](-[c:11]2[c:12]3[n:13]([cH:14][cH:15][cH:16]2)[n:17][c:18]([NH:20][c:22]2[cH:23][c:24]([S:28](=[O:29])(=[O:30])[CH3:31])[cH:25][cH:26][cH:27]2)[n:19]3)[cH:9][cH:10]1