HRID113767

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2734258

3-Fluorobenzenesulfonyl chloride

C6H4ClFO2S

HCID15509385

未命名化合物

结构：NC(c1ccccc1-c1ccccc1C(=O)NCc1ccccc1)S(=O)(=O)c1cccc(F)c1

HCID68971718

未命名化合物

PRODUCTS

生成物

结构：O=C(NCc1ccccc1)c1ccccc1-c1ccccc1CNS(=O)(=O)c1cccc(F)c1

HCID9847725

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7d8c432d79074425b0c3de98bba1ef15
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][C:9](=[O:10])[c:11]1[c:12](-[c:17]2[c:18]([CH2:23][NH2:24])[cH:19][cH:20][cH:21][cH:22]2)[cH:13][cH:14][cH:15][cH:16]1.[CH2:36]([NH:37][C:38]([c:39]1[c:40](-[c:41]2[cH:42][cH:43][cH:44][cH:45][c:46]2[CH:47]([S:48]([c:49]2[cH:50][cH:51][cH:52][c:53]([F:54])[cH:55]2)(=[O:56])=[O:57])[NH2:58])[cH:59][cH:60][cH:61][cH:62]1)=[O:63])[c:64]1[cH:65][cH:66][cH:67][cH:68][cH:69]1.[F:25][c:26]1[cH:27][c:28]([S:32](=[O:33])(=[O:34])[Cl:35])[cH:29][cH:30][cH:31]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][C:9](=[O:10])[c:11]1[c:12](-[c:17]2[c:18]([CH2:23][NH:24][S:32]([c:28]3[cH:27][c:26]([F:25])[cH:31][cH:30][cH:29]3)(=[O:33])=[O:34])[cH:19][cH:20][cH:21][cH:22]2)[cH:13][cH:14][cH:15][cH:16]1