HRID215129

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6386

tert-Butyl alcohol

C4H10O

HCID8100

1,5-Dibromopentane

C5H10Br2

HCID8471

Triethylamine

C6H15N

结构：COc1ccc2c(=O)n(C)c(CCN)c(-c3ccccc3)c2c1

HCID11404067

未命名化合物

PRODUCTS

生成物

HCID313

Hydrochloric Acid

ClH

结构：COc1ccc2c(=O)n(C)c(CCN3CCCCC3)c(-c3ccccc3)c2c1

HCID11303410

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ba18fad9b91340dfa265367f0ab043d0
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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