HRID947659

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

结构：N#Cc1ccc(NC(=O)C(O)(CSc2ccccc2)C(F)(F)F)cc1C(F)(F)F

HCID14064754

未命名化合物

HCID53442783

未命名化合物

PRODUCTS

生成物

结构：CC1(C)C2CCC1(C)C(C(=O)OC(CSc1ccccc1)(C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1)C(F)(F)F)C2

HCID86741201

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f056f306c6da49e6b82326033ed4d19d
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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