HRID152555

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

结构：Cc1ccc(S(=O)(=O)n2cc(-c3nc(NC(C)C4CCC(O)CC4)ncc3C#N)c3cc(C(F)(F)F)cnc32)cc1

HCID72277807

未命名化合物

PRODUCTS

生成物

HCID178427349

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-813587b5f67d4019ad95dd88413f38f3
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

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