HRID98212

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID13139

Diethyl phosphorochloridate

C4H10ClO3P

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

结构：Cc1nc(N2CCC(CO)CC2)c2c(C)cn(-c3c(C)cc(Br)cc3C)c2n1

HCID10478567

未命名化合物

PRODUCTS

生成物

结构：CCOP(=O)(OCC)OCC1CCN(c2nc(C)nc3c2c(C)cn3-c2c(C)cc(Br)cc2C)CC1

HCID60035416

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d18c72b499544122a3a8ca9a2d55f10b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[Br:1][c:2]1[cH:3][c:4]([CH3:28])[c:5](-[n:9]2[cH:10][c:11]([CH3:27])[c:12]3[c:13]2[n:14][c:15]([CH3:26])[n:16][c:17]3[N:18]2[CH2:19][CH2:20][CH:21]([CH2:24][OH:25])[CH2:22][CH2:23]2)[c:6]([CH3:8])[cH:7]1.[CH3:38][N:39]([CH3:40])[c:41]1[cH:42][cH:43][n:44][cH:45][cH:46]1.[Cl:47][CH2:48][Cl:49].[P:29](=[O:30])([O:31][CH2:32][CH3:33])([O:34][CH2:35][CH3:36])[Cl:37]>>[Br:1][c:2]1[cH:3][c:4]([CH3:28])[c:5](-[n:9]2[cH:10][c:11]([CH3:27])[c:12]3[c:13]2[n:14][c:15]([CH3:26])[n:16][c:17]3[N:18]2[CH2:19][CH2:20][CH:21]([CH2:24][O:25][P:29](=[O:30])([O:31][CH2:32][CH3:33])[O:34][CH2:35][CH3:36])[CH2:22][CH2:23]2)[c:6]([CH3:8])[cH:7]1