HRID124982

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID28486

Lithium ion

Li+

HCID3280088

未命名化合物

HCID11629607

2-Chloro-4-methylpyrimidine

C5H5ClN2

结构：COC(=O)c1cccc(NS(=O)(=O)c2cc(F)ccc2F)c1F

HCID58316996

Methyl 3-[[(2,5-difluorophenyl)sulfonyl]amino]-2-fluorobenzoate

C14H10F3NO4S

PRODUCTS

生成物

结构：O=C(Cc1ccnc(Cl)n1)c1cccc(NS(=O)(=O)c2cc(F)ccc2F)c1F

HCID86636576

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-da5e2cdcb3214f738cef1df2f7315d0e
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

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