HRID686260

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID1031

1-Propanol

C3H8O

HCID8058

Hexane

C6H14

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl Acetate

C4H8O2

HCID70966

Vanillylamine

C8H11NO2

HCID239484

6-Chloro-9-(oxolan-2-yl)-9H-purine

C9H9ClN4O

HCID5359277

6-Chloropurine

C5H3ClN4

PRODUCTS

产物

HCID44129503

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-ae90fc077dca4ae88ca708024456fc91
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应SMILES

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