HRID142789

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID4574913

未命名化合物

结构：COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1

HCID11269872

2-Dicyclohexylphosphino-2′,6′-dimethoxybiphenyl

C26H35O2P

HCID12622440

1,4-Dichloro-5,6,7,8-tetrahydrophthalazine

C8H8Cl2N2

HCID46929541

未命名化合物

PRODUCTS

生成物

结构：CNc1nccc(-c2cccnc2Oc2ccc(Nc3nnc(Cl)c4c3CCCC4)cc2)n1

HCID57756230

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3026289acf25474eb8340724c36548b7
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

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