HRID701582

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID962

Water

H2O

HCID6212

Chloroform

CHCl3

HCID8471

Triethylamine

C6H15N

HCID73238

4,5-Dimethyl-1,3-thiazol-2-amine

C5H8N2S

HCID94429

Triphosgene

C3Cl6O3

结构：COc1cc2nccc(Oc3ccc(N)c(C(F)(F)F)c3)c2cc1OC

HCID22637154

4-[(6,7-Dimethoxy-4-quinolinyl)oxy]-2-(trifluoromethyl)benzenamine

C18H15F3N2O3

PRODUCTS

生成物

结构：COc1cc2nccc(Oc3ccc(NC(=O)Nc4nc(C)c(C)s4)c(C(F)(F)F)c3)c2cc1OC

HCID23118585

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2010775b25d54fe39a4f6e8ac990aca4
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

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]([C:23]([F:24])([F:25])[F:26])[c:19]([NH2:20])[cH:21][cH:22]3)[cH:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14].[CH3:27][CH2:28][N:29]([CH2:30][CH3:31])[CH2:32][CH3:33].[CH:55]([Cl:56])([Cl:57])[Cl:58].[Cl:34][C:35]([Cl:36])([O:37][C:38]([O:39][C:40]([Cl:41])([Cl:42])[Cl:43])=[O:44])[Cl:45].[ClH:46].[NH2:47][c:48]1[s:49][c:50]([CH3:54])[c:51]([CH3:53])[n:52]1.[OH2:59]>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([O:15][c:16]3[cH:17][c:18]([C:23]([F:24])([F:25])[F:26])[c:19]([NH:20][C:38](=[O:44])[NH:47][c:48]4[s:49][c:50]([CH3:54])[c:51]([CH3:53])[n:52]4)[cH:21][cH:22]3)[cH:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14]