HRID1224142

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID24648

Sulfuryl chloride

Cl2O2S

HCID2777188

3-(Trifluoromethoxy)anisole

C8H7F3O2

结构：COc1ccc(C)cc1C1(O)C(=O)Nc2ncc(Br)cc21

HCID67428555

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(S(=O)(=O)N2C(=O)C(O)(c3cc(C)ccc3OC)c3cc(Br)cnc32)c(OC(F)(F)F)c1

HCID67427767

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-314b4ea3167c470c877f454168bf339a
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

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