HRID1204810

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID6344

Dichloromethane

CH2Cl2

HCID8028

Tetrahydrofuran

C4H8O

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID81531

Diisopropylethylamine

C8H19N

HCID3145400

[3-(1H-Benzoimidazol-2-yl)-propyl]-methyl-amine

C11H15N3

HCID68412916

未命名化合物

PRODUCTS

生成物

结构：CN(CCCc1nc2ccccc2[nH]1)C(=O)CC1(O)CC2CCC1C=C2c1cccs1

HCID68412936

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5fb0b2eb0c184342a6e59dfe9b4a4679
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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