HRID2122283

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID176

Acetic Acid

C2H4O2

HCID7972

4-Methylmorpholine

C5H11NO

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

结构：COc1cc(Oc2nc(-c3cccc(N)c3)nn3c(C)nc(C)c23)cc(OC)c1OC

HCID18449104

未命名化合物

PRODUCTS

生成物

结构：COc1cc(Oc2nc(-c3cccc(NC(C)=O)c3)nn3c(C)nc(C)c23)cc(OC)c1OC

HCID18449116

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-778f7b64d9a04c1c87e117fb99546d1f
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

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