HRID110609

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID11776

Triphenylphosphine

C18H15P

HCID17291

3-Methoxybutan-1-ol

C5H12O2

HCID220568

Diethyl azodicarboxylate

C6H10N2O4

HCID9817332

o-Desmethyl metoclopramide

C13H20ClN3O2

PRODUCTS

生成物

结构：CCN(CC)CCNC(=O)c1cc(Cl)c(N)cc1OCCC(C)OC

HCID9929376

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-dca9b5394f5a409da6ed61053913692f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH3:39][O:40][CH:41]([CH2:42][CH2:43][OH:44])[CH3:45].[NH2:1][c:2]1[cH:3][c:4]([OH:19])[c:5]([C:6](=[O:7])[NH:8][CH2:9][CH2:10][N:11]([CH2:12][CH3:13])[CH2:14][CH3:15])[cH:16][c:17]1[Cl:18].[O:46]=[C:47]([O:48][CH2:49][CH3:50])[N:51]=[N:52][C:53]([O:54][CH2:55][CH3:56])=[O:57].[O:58]1[CH2:59][CH2:60][CH2:61][CH2:62]1.[c:20]1([P:21]([c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[cH:34][cH:35][cH:36][cH:37][cH:38]1>>[NH2:1][c:2]1[cH:3][c:4]([O:19][CH2:43][CH2:42][CH:41]([O:40][CH3:39])[CH3:45])[c:5]([C:6](=[O:7])[NH:8][CH2:9][CH2:10][N:11]([CH2:12][CH3:13])[CH2:14][CH3:15])[cH:16][c:17]1[Cl:18]