HRID305321

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID70297

Benzenecarboperoxoic acid, 3-chloro-

C7H5ClO3

结构：COCCc1noc(C2CC(c3ccc(CC(F)(F)F)cc3)CN(C(=O)N3CCSCC3)C2)n1

HCID59606583

{3-[3-(2-Methoxyethyl)-1,2,4-oxadiazol-5-yl]-5-[4-(2,2,2-trifluoroethyl)phenyl]piperidin-1-yl}-(thiomorpholin-4-yl)methanone

C23H29F3N4O3S

PRODUCTS

生成物

结构：COCCc1noc(C2CC(c3ccc(CC(F)(F)F)cc3)CN(C(=O)N3CCS(=O)CC3)C2)n1

HCID59606567

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b760e321e9c6463db201ab7646cc0e08
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][O:2][CH2:3][CH2:4][c:5]1[n:6][o:7][c:8]([CH:10]2[CH2:11][N:12]([C:27](=[O:28])[N:29]3[CH2:30][CH2:31][S:32][CH2:33][CH2:34]3)[CH2:13][CH:14]([c:16]3[cH:17][cH:18][c:19]([CH2:22][C:23]([F:24])([F:25])[F:26])[cH:20][cH:21]3)[CH2:15]2)[n:9]1.[OH:35][O:36][C:37]([c:38]1[cH:39][c:40]([Cl:41])[cH:42][cH:43][cH:44]1)=[O:45]>>[CH3:1][O:2][CH2:3][CH2:4][c:5]1[n:6][o:7][c:8]([CH:10]2[CH2:11][N:12]([C:27](=[O:28])[N:29]3[CH2:30][CH2:31][S:32](=[O:35])[CH2:33][CH2:34]3)[CH2:13][CH:14]([c:16]3[cH:17][cH:18][c:19]([CH2:22][C:23]([F:24])([F:25])[F:26])[cH:20][cH:21]3)[CH2:15]2)[n:9]1