HRID109850

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID24386

Thionyl chloride

Cl2OS

HCID21081530

1-[(4-Fluorophenyl)carbamoyl]cyclopropane-1-carboxylic acid

C11H10FNO3

HCID23153205

4-(4-Amino-2-fluorophenoxy)pyridine-2-carboxamide

C12H10FN3O2

PRODUCTS

生成物

结构：NC(=O)c1cc(Oc2ccc(NC(=O)C3(C(=O)Nc4ccc(F)cc4)CC3)cc2F)ccn1

HCID59596985

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-197ec831129d44d2b8bf54746c3433aa
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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