HRID1235249

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6342

Acetonitrile

C2H3N

HCID8471

Triethylamine

C6H15N

HCID88969

Benzoyl chloride, 2-methoxy-

C8H7ClO2

HCID22613801

未命名化合物

PRODUCTS

生成物

结构：COc1ccccc1C(=O)c1nccn1CC(CCOC1CCCCO1)c1ccc(Cl)c(Cl)c1

HCID22613814

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-87be688c637141d2888faa603999e0b3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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