HRID816318

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID1833

5-Methoxy-1H-indole-3-ethanamine

C11H14N2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID7972

4-Methylmorpholine

C5H11NO

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

2 次

结构：CC(C)CC(Oc1ccc(C#N)c(C(F)(F)F)c1)C(=O)O

HCID57598540

未命名化合物

PRODUCTS

生成物

结构：COc1ccc2[nH]cc(CCNC(=O)C(CC(C)C)Oc3ccc(C#N)c(C(F)(F)F)c3)c2c1

HCID57598470

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-10e81e44e5b14fea82b03ab41fe2b968
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:1](#[N:2])[c:3]1[c:4]([C:18]([F:19])([F:20])[F:21])[cH:5][c:6]([O:7][CH:8]([C:9](=[O:10])[OH:11])[CH2:12][CH:13]([CH3:14])[CH3:15])[cH:16][cH:17]1.[CH3:42][N:43]1[CH2:44][CH2:45][O:46][CH2:47][CH2:48]1.[CH3:50][O:51][c:52]1[cH:53][cH:54][c:55]2[nH:56][cH:57][c:58]([CH2:59][CH2:60][NH2:61])[c:62]2[cH:63]1.[ClH:49].[O:64]=[CH:65][N:66]([CH3:67])[CH3:68].[OH:22][n:23]1[c:24]2[cH:25][cH:26][cH:27][cH:28][c:29]2[n:30][n:31]1.[OH:32][n:33]1[c:34]2[c:35]([cH:36][cH:37][cH:38][cH:39]2)[n:40][n:41]1>>[C:1](#[N:2])[c:3]1[c:4]([C:18]([F:19])([F:20])[F:21])[cH:5][c:6]([O:7][CH:8]([C:9](=[O:11])[NH:61][CH2:60][CH2:59][c:58]2[cH:57][nH:56][c:55]3[cH:54][cH:53][c:52]([O:51][CH3:50])[cH:63][c:62]32)[CH2:12][CH:13]([CH3:14])[CH3:15])[cH:16][cH:17]1