HRID960814

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CCOC(=O)CC1CCc2cc(SCc3ccc(-c4ccc(C(F)(F)F)cn4)cc3)ccc2O1

HCID20770775

未命名化合物

HCID22280022

{4-[5-(Trifluoromethyl)pyridin-2-yl]phenyl}methanol

C13H10F3NO

PRODUCTS

生成物

结构：O=C(O)CC1CCc2cc(SCc3ccc(-c4ccc(C(F)(F)F)cn4)cc3)ccc2O1

HCID11155377

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-bc08aebe20294ead97d58592366dab9b
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

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