HRID196545

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID22179302

Furan-3-sulfonyl chloride

C4H3ClO3S

结构：CC(C)(C)OC(=O)NC(C)(C)c1nc(-c2cccc(N)c2F)c(-c2ccnc(Cl)n2)s1

HCID57989936

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NC(C)(C)c1nc(-c2cccc(NS(=O)(=O)c3ccoc3)c2F)c(-c2ccnc(Cl)n2)s1

HCID57989964

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-be208e76158e4012bedcd267568f8baf
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[NH2:1][c:2]1[c:3]([F:31])[c:4](-[c:8]2[n:9][c:10]([C:20]([CH3:21])([CH3:22])[NH:23][C:24]([O:25][C:26]([CH3:27])([CH3:28])[CH3:29])=[O:30])[s:11][c:12]2-[c:13]2[n:14][c:15]([Cl:19])[n:16][cH:17][cH:18]2)[cH:5][cH:6][cH:7]1.[cH:41]1[cH:42][cH:43][n:44][cH:45][cH:46]1.[o:32]1[cH:33][c:34]([S:37](=[O:38])(=[O:39])[Cl:40])[cH:35][cH:36]1>>[NH:1]([c:2]1[c:3]([F:31])[c:4](-[c:8]2[n:9][c:10]([C:20]([CH3:21])([CH3:22])[NH:23][C:24]([O:25][C:26]([CH3:27])([CH3:28])[CH3:29])=[O:30])[s:11][c:12]2-[c:13]2[n:14][c:15]([Cl:19])[n:16][cH:17][cH:18]2)[cH:5][cH:6][cH:7]1)[S:37]([c:34]1[cH:33][o:32][cH:36][cH:35]1)(=[O:38])=[O:39]