HRID822805

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID679

Dimethyl sulfoxide

C2H6OS

HCID81531

Diisopropylethylamine

C8H19N

HCID2762894

3-Amino-5-methylpyridine

C6H8N2

HCID66833837

未命名化合物

结构：FC(F)(F)c1ccc(Oc2cccc(C=C3CCNCC3)c2)nc1

HCID66876162

未命名化合物

PRODUCTS

生成物

结构：Cc1cncc(NC(=O)N2CCC(=Cc3cccc(Oc4ccc(C(F)(F)F)cn4)c3)CC2)c1

HCID24967993

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-238d366d3503477eb66e01fc4da66485
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH3:26][c:27]1[cH:28][c:29]([NH:33][C:34]([O:35][c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)=[O:36])[cH:30][n:31][cH:32]1.[CH3:60][S:61]([CH3:62])=[O:63].[CH:51]([N:52]([CH:53]([CH3:54])[CH3:55])[CH2:56][CH3:57])([CH3:58])[CH3:59].[ClH:1].[NH2:43][c:44]1[cH:45][n:46][cH:47][c:48]([CH3:49])[cH:50]1.[NH:2]1[CH2:3][CH2:4][C:5](=[CH:8][c:9]2[cH:10][c:11]([O:12][c:13]3[n:14][cH:15][c:16]([C:19]([F:20])([F:21])[F:22])[cH:17][cH:18]3)[cH:23][cH:24][cH:25]2)[CH2:6][CH2:7]1>>[N:2]1([C:34]([NH:33][c:29]2[cH:28][c:27]([CH3:26])[cH:32][n:31][cH:30]2)=[O:35])[CH2:3][CH2:4][C:5](=[CH:8][c:9]2[cH:10][c:11]([O:12][c:13]3[n:14][cH:15][c:16]([C:19]([F:20])([F:21])[F:22])[cH:17][cH:18]3)[cH:23][cH:24][cH:25]2)[CH2:6][CH2:7]1