HRID2330315

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1672

3-Methoxypropylamine

C4H11NO

HCID6344

Dichloromethane

CH2Cl2

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID81531

Diisopropylethylamine

C8H19N

HCID59252475

未命名化合物

PRODUCTS

生成物

结构：COCCCNC(=O)c1csc(-c2cnc(-c3ccccc3)nc2)n1

HCID59252401

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-596dc5d8302541798aa568e6879b02da
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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