HRID2141376

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID8028

Tetrahydrofuran

C4H8O

HCID598770

4-Bromo-N,N-diisopropylbenzylamine

C13H20BrN

结构：CON(C)C(=O)C1CCN(C(c2ccccc2)(c2ccccc2)c2ccccc2)CC1

HCID22628088

未命名化合物

HCID178418339

Butyllithium

C4H9Li

PRODUCTS

生成物

结构：CC(C)N(Cc1ccc(C(=O)C2CCN(C(c3ccccc3)(c3ccccc3)c3ccccc3)CC2)cc1)C(C)C

HCID22627953

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-759bb8badbf34e1c9ed3ee0198950350
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[Br:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][N:7]([CH:8]([CH3:9])[CH3:10])[CH:11]([CH3:12])[CH3:13])[cH:14][cH:15]1.[CH2:54]1[O:55][CH2:56][CH2:57][CH2:58]1.[CH3:16][CH2:17][CH2:18][CH2:19][Li:20].[CH3:21][N:22]([O:23][CH3:24])[C:25](=[O:26])[CH:27]1[CH2:28][CH2:29][N:30]([C:33]([c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)([c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)[CH2:31][CH2:32]1.[Cl-:52].[NH4+:53]>>[c:2]1([C:25](=[O:26])[CH:27]2[CH2:28][CH2:29][N:30]([C:33]([c:34]3[cH:35][cH:36][cH:37][cH:38][cH:39]3)([c:40]3[cH:41][cH:42][cH:43][cH:44][cH:45]3)[c:46]3[cH:47][cH:48][cH:49][cH:50][cH:51]3)[CH2:31][CH2:32]2)[cH:3][cH:4][c:5]([CH2:6][N:7]([CH:8]([CH3:9])[CH3:10])[CH:11]([CH3:12])[CH3:13])[cH:14][cH:15]1