HRID664517

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID166653

Hydride

H-

HCID2763290

4-(chloromethyl)-1,3-thiazole

C4H4ClNS

结构：CCCCc1ncc(C=C2C(=O)N(CCCC)C(=O)N2Cc2cscn2)n1Cc1ccc(C(=O)OC)cc1

HCID49823652

未命名化合物

PRODUCTS

生成物

HCID313

Hydrochloric Acid

ClH

HCID49823652

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-28d418773100439c98e72231d3dfc64a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[n:6]([CH2:28][c:29]2[cH:30][cH:31][c:32]([C:33](=[O:34])[O:35][CH3:36])[cH:37][cH:38]2)[c:7]([CH:10]=[C:11]2[N:12]([CH2:22][c:23]3[n:24][cH:25][s:26][cH:27]3)[C:13](=[O:21])[N:14]([CH2:17][CH2:18][CH2:19][CH3:20])[C:15]2=[O:16])[cH:8][n:9]1.[Cl:42][CH2:43][c:44]1[n:45][cH:46][s:47][cH:48]1.[ClH:41].[H-:39].[Na+:40].[O:49]=[CH:50][N:51]([CH3:52])[CH3:53]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[n:6]([CH2:28][c:29]2[cH:30][cH:31][c:32]([C:33](=[O:34])[O:35][CH3:36])[cH:37][cH:38]2)[c:7]([CH:10]=[C:11]2[N:12]([CH2:22][c:23]3[n:24][cH:25][s:26][cH:27]3)[C:13](=[O:21])[N:14]([CH2:17][CH2:18][CH2:19][CH3:20])[C:15]2=[O:16])[cH:8][n:9]1.[ClH:42]