HRID2147994

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID6344

Dichloromethane

CH2Cl2

HCID7972

4-Methylmorpholine

C5H11NO

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

结构：O=C(O)C(CS(=O)(=O)Cc1ccccc1)NC(=O)N1CCOCC1

HCID11279734

未命名化合物

HCID21082274

未命名化合物

PRODUCTS

生成物

结构：CC(CNc1ccc(OC(F)(F)F)cc1)NC(=O)C(CS(=O)(=O)Cc1ccccc1)NC(=O)N1CCOCC1

HCID178456781

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-834d66bdbf24419e9a799e4e323683cc
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

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