HRID299140

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID81531

Diisopropylethylamine

C8H19N

HCID1989641

2-Methyl-2-morpholinopropan-1-amine

C8H18N2O

结构：CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)N(C(=O)OC(C)(C)C)c1nc(Cl)nc(Cl)c1F

HCID58000755

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)N(C(=O)OC(C)(C)C)c1nc(Cl)nc(NCC(C)(C)N2CCOCC2)c1F

HCID86636980

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-dc607c7c4c8d4219b2684d8921f486c5
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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