HRID145708

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID6212

Chloroform

CHCl3

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID94429

Triphosgene

C3Cl6O3

HCID170678

2-Pyridinamine, 5-bromo-6-methyl-

C6H7BrN2

HCID21890421

4-[(6,7-Dimethoxyquinolin-4-yl)oxy]-2,5-dimethylaniline

C19H20N2O3

PRODUCTS

生成物

结构：COc1cc2nccc(Oc3cc(C)c(NC(=O)Nc4ccc(Br)c(C)n4)cc3C)c2cc1OC

HCID69353472

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-943478ec3ecd4f6b962993afa29c690f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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