HRID304094

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11572816

2-iodo-4-(trifluoromethyl)phenol

C7H4F3IO

结构：COc1ccc(CN(c2ncns2)S(=O)(=O)c2cc(F)c(F)cc2F)c(OC)c1

HCID59436583

N-[(2,4-Dimethoxyphenyl)methyl]-2,4,5-trifluoro-N-(1,2,4-thiadiazol-5-yl)benzene-1-sulfonamide

C17H14F3N3O4S2

PRODUCTS

生成物

结构：COc1ccc(CN(c2ncns2)S(=O)(=O)c2cc(F)c(Oc3ccc(C(F)(F)F)cc3I)cc2F)c(OC)c1

HCID59436549

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1917dc2848a649cb87b89adfaece89ce
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][c:3]1[c:4]([CH2:5][N:6]([S:7](=[O:8])(=[O:9])[c:10]2[c:11]([F:18])[cH:12][c:13]([F:17])[c:14]([F:16])[cH:15]2)[c:19]2[n:20][cH:21][n:22][s:23]2)[cH:24][cH:25][c:26]([O:28][CH3:29])[cH:27]1.[I:30][c:31]1[c:32]([OH:41])[cH:33][cH:34][c:35]([C:37]([F:38])([F:39])[F:40])[cH:36]1>>[CH3:1][O:2][c:3]1[c:4]([CH2:5][N:6]([S:7](=[O:8])(=[O:9])[c:10]2[c:11]([F:18])[cH:12][c:13]([O:41][c:32]3[c:31]([I:30])[cH:36][c:35]([C:37]([F:38])([F:39])[F:40])[cH:34][cH:33]3)[c:14]([F:16])[cH:15]2)[c:19]2[n:20][cH:21][n:22][s:23]2)[cH:24][cH:25][c:26]([O:28][CH3:29])[cH:27]1