HRID1558011

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

HCID15205

Butanoic acid, 4-(diethylamino)-4-oxo- (9CI)

C8H15NO3

HCID75567

4-Pyrrolidinopyridine

C9H12N2

结构：Cn1c(C(F)(F)F)cc(=O)n(-c2cc(O)c(Cl)cc2F)c1=O

HCID11267757

未命名化合物

PRODUCTS

生成物

结构：CCN(CC)C(=O)CCC(=O)Oc1cc(-n2c(=O)cc(C(F)(F)F)n(C)c2=O)c(F)cc1Cl

HCID20025994

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-22f46044483c4d7bab1b2c411f954a5e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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