HRID1559206

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID2777972

3,3,3-Trifluoropropionic acid

C3H3F3O2

结构：Nc1ncc(Br)cc1C(=O)c1cccc(N2CCCNCC2)n1

HCID24871523

未命名化合物

PRODUCTS

生成物

结构：Nc1ncc(Br)cc1C(=O)c1cccc(N2CCCN(C(=O)CC(F)(F)F)CC2)n1

HCID24992834

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fec34b8849ce4dc391a00ddce74063ea
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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