HRID137880

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11817675

1-(4-BROMOPHENYL)-4-METHYLPIPERAZINE

C11H15BrN2

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

HCID24946987

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

C36H52P2

结构：CC(C)S(=O)(=O)c1ccc(-c2cccn3nc(N)nc23)cc1

HCID67481399

未命名化合物

PRODUCTS

生成物

结构：CC(C)S(=O)(=O)c1ccc(-c2cccn3nc(Nc4ccc(N5CCN(C)CC5)cc4)nc23)cc1

HCID67478979

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0b8bea36cbc942b696c6139004a96400
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

[Br:23][c:24]1[cH:25][cH:26][c:27]([N:30]2[CH2:31][CH2:32][N:33]([CH3:36])[CH2:34][CH2:35]2)[cH:28][cH:29]1.[CH3:1][CH:2]([CH3:3])[S:4](=[O:5])(=[O:6])[c:7]1[cH:8][cH:9][c:10](-[c:13]2[c:14]3[n:15]([cH:16][cH:17][cH:18]2)[n:19][c:20]([NH2:22])[n:21]3)[cH:11][cH:12]1.[CH:37]1([P:38]([CH:39]2[CH2:40][CH2:41][CH2:42][CH2:43][CH2:44]2)[c:45]2[cH:46][cH:47][cH:48][cH:49][c:50]2-[c:51]2[cH:52][cH:53][cH:54][cH:55][c:56]2[P:57]([CH:58]2[CH2:59][CH2:60][CH2:61][CH2:62][CH2:63]2)[CH:64]2[CH2:65][CH2:66][CH2:67][CH2:68][CH2:69]2)[CH2:70][CH2:71][CH2:72][CH2:73][CH2:74]1>>[CH3:1][CH:2]([CH3:3])[S:4](=[O:5])(=[O:6])[c:7]1[cH:8][cH:9][c:10](-[c:13]2[c:14]3[n:15]([cH:16][cH:17][cH:18]2)[n:19][c:20]([NH:22][c:24]2[cH:25][cH:26][c:27]([N:30]4[CH2:31][CH2:32][N:33]([CH3:36])[CH2:34][CH2:35]4)[cH:28][cH:29]2)[n:21]3)[cH:11][cH:12]1