HRID933324

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID6342

Acetonitrile

C2H3N

HCID7666

Phenethyl bromide

C8H9Br

HCID8471

Triethylamine

C6H15N

反应SMILES：Cc1cc(OCC(=O)N(C)C2CCNCC2)c(C)c(C)c1N

HCID9861312

未命名化合物

PRODUCTS

产物

反应SMILES：Cc1cc(OCC(=O)N(C)C2CCN(CCc3ccccc3)CC2)c(C)c(C)c1N

HCID22245767

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-c5ee5104987c4a8ea6bd525271f3e964
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应SMILES

[CH2:1]([CH2:2][c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[Br:9].[CH3:32][CH2:33][N:34]([CH2:35][CH3:36])[CH2:37][CH3:38].[CH3:41][C:42]#[N:43].[Cl-:39].[NH2:10][c:11]1[c:12]([CH3:31])[c:13]([CH3:30])[c:14]([O:15][CH2:16][C:17](=[O:18])[N:19]([CH:20]2[CH2:21][CH2:22][NH:23][CH2:24][CH2:25]2)[CH3:26])[cH:27][c:28]1[CH3:29].[NH4+:40]>>[CH2:1]([CH2:2][c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[N:23]1[CH2:22][CH2:21][CH:20]([N:19]([C:17]([CH2:16][O:15][c:14]2[c:13]([CH3:30])[c:12]([CH3:31])[c:11]([NH2:10])[c:28]([CH3:29])[cH:27]2)=[O:18])[CH3:26])[CH2:25][CH2:24]1