HRID1132600

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID9773

Ethanamine, 2,2,2-trifluoro-

C2H4F3N

结构：O=C(O)CNC(=O)c1ccc(C2=NOC(c3cc(Cl)cc(Cl)c3)(C(F)(F)F)C2)c2ccccc12

HCID68512729

未命名化合物

PRODUCTS

生成物

结构：O=C(CNC(=O)c1ccc(C2=NOC(c3cc(Cl)cc(Cl)c3)(C(F)(F)F)C2)c2ccccc12)NCC(F)(F)F

HCID44598517

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1610481bcad3482fbdd2e12d7fa61826
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[Cl:1][c:2]1[cH:3][c:4]([C:9]2([C:31]([F:32])([F:33])[F:34])[CH2:10][C:11]([c:14]3[cH:15][cH:16][c:17]([C:24](=[O:25])[NH:26][CH2:27][C:28](=[O:29])[OH:30])[c:18]4[cH:19][cH:20][cH:21][cH:22][c:23]34)=[N:12][O:13]2)[cH:5][c:6]([Cl:8])[cH:7]1.[Cl:41][CH2:42][Cl:43].[F:35][C:36]([CH2:37][NH2:38])([F:39])[F:40]>>[Cl:1][c:2]1[cH:3][c:4]([C:9]2([C:31]([F:32])([F:33])[F:34])[CH2:10][C:11]([c:14]3[cH:15][cH:16][c:17]([C:24](=[O:25])[NH:26][CH2:27][C:28](=[O:29])[NH:38][CH2:37][C:36]([F:35])([F:39])[F:40])[c:18]4[cH:19][cH:20][cH:21][cH:22][c:23]34)=[N:12][O:13]2)[cH:5][c:6]([Cl:8])[cH:7]1