HRID700073

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID7912

Diisopropylamine

C6H15N

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl Acetate

C4H8O2

HCID87017

Thiophene, 3-chloro-

C4H3ClS

HCID10013602

4-Piperidineacetaldehyde, 1-(phenylmethyl)-

C14H19NO

HCID178418339

Butyllithium

C4H9Li

PRODUCTS

产物

HCID22248178

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-06c768bcc0564c74971d135951d221e9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应SMILES

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