HRID2159491

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID8857

Ethyl acetate

C4H8O2

HCID31275

1,4-Dioxane

C4H8O2

HCID11183174

4-chloro-6-methoxyquinazoline

C9H7ClN2O

HCID66876595

未命名化合物

PRODUCTS

生成物

结构：COc1ccc2ncnc(Oc3cccc(NC(=O)Nc4cc(C(C)(C)C)on4)c3)c2c1

HCID44243130

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4b1fdb3b50c642148269890d36bc16ca
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([NH:10][C:11](=[O:12])[NH:13][c:14]2[cH:15][c:16]([OH:20])[cH:17][cH:18][cH:19]2)[n:8][o:9]1.[CH3:35][CH2:36][O:37][C:38]([CH3:39])=[O:40].[Cl:21][c:22]1[n:23][cH:24][n:25][c:26]2[cH:27][cH:28][c:29]([O:32][CH3:33])[cH:30][c:31]12.[ClH:34].[O:41]1[CH2:42][CH2:43][O:44][CH2:45][CH2:46]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([NH:10][C:11](=[O:12])[NH:13][c:14]2[cH:15][c:16]([O:20][c:22]3[n:23][cH:24][n:25][c:26]4[cH:27][cH:28][c:29]([O:32][CH3:33])[cH:30][c:31]34)[cH:17][cH:18][cH:19]2)[n:8][o:9]1