HRID2155019

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID13139

Diethyl phosphorochloridate

C4H10ClO3P

结构：COc1ccc(-c2nn3c(NCCCCN)cccc3c2-c2ccnc(NC3CCCC3)n2)cc1

HCID10140154

未命名化合物

PRODUCTS

生成物

结构：CCOP(=O)(NCCCCNc1cccc2c(-c3ccnc(NC4CCCC4)n3)c(-c3ccc(OC)cc3)nn12)OCC

HCID10232560

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-37755e3205574614b08944b766b2f660
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

[CH3:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42].[CH:1]1([NH:6][c:7]2[n:8][cH:9][cH:10][c:11](-[c:13]3[c:14](-[c:28]4[cH:29][cH:30][c:31]([O:34][CH3:35])[cH:32][cH:33]4)[n:15][n:16]4[c:17]3[cH:18][cH:19][cH:20][c:21]4[NH:22][CH2:23][CH2:24][CH2:25][CH2:26][NH2:27])[n:12]2)[CH2:2][CH2:3][CH2:4][CH2:5]1.[Cl:52][CH2:53][Cl:54].[P:43](=[O:44])([O:45][CH2:46][CH3:47])([O:48][CH2:49][CH3:50])[Cl:51]>>[CH:1]1([NH:6][c:7]2[n:8][cH:9][cH:10][c:11](-[c:13]3[c:14](-[c:28]4[cH:29][cH:30][c:31]([O:34][CH3:35])[cH:32][cH:33]4)[n:15][n:16]4[c:17]3[cH:18][cH:19][cH:20][c:21]4[NH:22][CH2:23][CH2:24][CH2:25][CH2:26][NH:27][P:43](=[O:44])([O:45][CH2:46][CH3:47])[O:48][CH2:49][CH3:50])[n:12]2)[CH2:2][CH2:3][CH2:4][CH2:5]1