HRID168300

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID11565

3,5-Dimethylpyridine

C7H9N

HCID11446888

5,8-Dimethoxy-[1,2,4]triazolo[1,5-c]pyrimidin-2-amine

C7H9N5O2

HCID16050308

2-(2,2-Difluoroethoxy)-6-(trifluoromethyl)benzene-1-sulfonyl chloride

C9H6ClF5O3S

PRODUCTS

生成物

结构：COc1cnc(OC)n2nc(NS(=O)(=O)c3c(OCC(F)F)cccc3C(F)(F)F)nc12

HCID11784975

Penoxsulam

C16H14F5N5O5S

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6befc3a1fad04a1797b3a2e4b0e99a77
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[CH3:42][S:43]([CH3:44])=[O:45].[F:15][CH:16]([CH2:17][O:18][c:19]1[c:20]([S:29](=[O:30])(=[O:31])[Cl:32])[c:21]([C:25]([F:26])([F:27])[F:28])[cH:22][cH:23][cH:24]1)[F:33].[NH2:1][c:2]1[n:3][n:4]2[c:5]([O:13][CH3:14])[n:6][cH:7][c:8]([O:11][CH3:12])[c:9]2[n:10]1.[n:34]1[cH:35][c:36]([CH3:37])[cH:38][c:39]([CH3:40])[cH:41]1>>[NH:1]([c:2]1[n:3][n:4]2[c:5]([O:13][CH3:14])[n:6][cH:7][c:8]([O:11][CH3:12])[c:9]2[n:10]1)[S:29]([c:20]1[c:19]([O:18][CH2:17][CH:16]([F:15])[F:33])[cH:24][cH:23][cH:22][c:21]1[C:25]([F:26])([F:27])[F:28])(=[O:30])=[O:31]