HRID2125802

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID6344

Dichloromethane

CH2Cl2

HCID57516850

1-(2,2-Difluoro-1,3-benzodioxol-5-yl)cyclopropanecarbonyl chloride

C11H7ClF2O3

结构：COC(=O)c1ccc(N)nc1-c1cccc(C(=O)OC(C)(C)C)c1

HCID59166112

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1ccc(NC(=O)C2(c3ccc4c(c3)OC(F)(F)O4)CC2)nc1-c1cccc(C(=O)OC(C)(C)C)c1

HCID59166109

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6fb8a4565c0e4f2d90fc70674ee34e1a
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

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