HRID2145037

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(Nc2nc(-c3ccc(N)cc3)nn3c(C)nc(C)c23)cc(OC)c1OC

HCID11742877

未命名化合物

PRODUCTS

生成物

结构：COc1cc(Nc2nc(-c3ccc(NC(C)=O)cc3)nn3c(C)nc(C)c23)cc(OC)c1OC

HCID18449122

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-71d6b216ada14fe4b2d1be394fbc557f
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].[NH2:26][c:27]1[cH:28][cH:29][c:30](-[c:33]2[n:34][n:35]3[c:36]([c:37]([NH:39][c:40]4[cH:41][c:42]([O:50][CH3:51])[c:43]([O:48][CH3:49])[c:44]([O:46][CH3:47])[cH:45]4)[n:38]2)[c:52]([CH3:56])[n:53][c:54]3[CH3:55])[cH:31][cH:32]1.[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:26][c:27]1[cH:28][cH:29][c:30](-[c:33]2[n:34][n:35]3[c:36]([c:37]([NH:39][c:40]4[cH:41][c:42]([O:50][CH3:51])[c:43]([O:48][CH3:49])[c:44]([O:46][CH3:47])[cH:45]4)[n:38]2)[c:52]([CH3:56])[n:53][c:54]3[CH3:55])[cH:31][cH:32]1