HRID1152115

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID3776

Isopropanol

C3H8O

HCID6212

Chloroform

CHCl3

HCID6344

Dichloromethane

CH2Cl2

HCID8857

Ethyl acetate

C4H8O2

HCID11776

Triphenylphosphine

C18H15P

HCID12308

3-Bromo-1-propanol

C3H7BrO

结构：Nc1ncnc2nc(Sc3cc4c(cc3Br)OCO4)[nH]c12

HCID11474022

8-(6-Bromo-benzo[1,3]dioxol-5-ylsulfanyl)adenine

C12H8BrN5O2S

PRODUCTS

生成物

结构：Nc1ncnc2c1nc(Sc1cc3c(cc1Br)OCO3)n2CCCBr

HCID11518747

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d85ecf7d767c41b8a75296933e57214b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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