HRID1202223

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl Acetate

C4H8O2

HCID28486

Lithium ion

Li+

HCID3280088

未命名化合物

HCID11629607

2-Chloro-4-methylpyrimidine

C5H5ClN2

HCID57989692

Benzoic acid, 3-[[(2,6-difluorophenyl)sulfonyl]amino]-2-fluoro-, methyl ester

C14H10F3NO4S

PRODUCTS

产物

HCID57989720

N-[3-[2-(2-Chloro-4-pyrimidinyl)acetyl]-2-fluorophenyl]-2,6-difluorobenzenesulfonamide

C18H11ClF3N3O3S

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-ed8ccd2bf1a6427c884a0ce2b914ffbe
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应SMILES

[CH2:43]1[O:44][CH2:45][CH2:46][CH2:47]1.[CH3:25][Si:26]([N-:27][Si:28]([CH3:29])([CH3:30])[CH3:31])([CH3:32])[CH3:33].[CH3:48][CH2:49][O:50][C:51]([CH3:52])=[O:53].[Cl:34][c:35]1[n:36][cH:37][cH:38][c:39]([CH3:41])[n:40]1.[ClH:42].[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:17])[O:18][CH3:19])[cH:20][cH:21][cH:22]2)[c:4]([F:8])[cH:5][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:17])[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)[c:4]([F:8])[cH:5][cH:6][cH:7]1