HRID2123585

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID2795525

4-Methylthiophene-2-carbonyl chloride

C6H5ClOS

结构：Cn1c(-c2ccnc(N)n2)cc2c1CCN(C(=O)OC(C)(C)C)C2=O

HCID24776553

未命名化合物

PRODUCTS

生成物

结构：Cc1csc(C(=O)Nc2nccc(-c3cc4c(n3C)CCN(C(=O)OC(C)(C)C)C4=O)n2)c1

HCID67284750

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1a5a92fa0cc44919b34f9ecaa426f0a5
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[C:9](=[O:25])[c:10]2[c:11]([n:14]([CH3:24])[c:15](-[c:17]3[n:18][c:19]([NH2:23])[n:20][cH:21][cH:22]3)[cH:16]2)[CH2:12][CH2:13]1.[CH3:26][c:27]1[cH:28][c:29]([C:32](=[O:33])[Cl:34])[s:30][cH:31]1.[CH3:41][N:42]([c:43]1[cH:44][cH:45][n:46][cH:47][cH:48]1)[CH3:49].[cH:35]1[cH:36][cH:37][n:38][cH:39][cH:40]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[C:9](=[O:25])[c:10]2[c:11]([n:14]([CH3:24])[c:15](-[c:17]3[n:18][c:19]([NH:23][C:32]([c:29]4[cH:28][c:27]([CH3:26])[cH:31][s:30]4)=[O:33])[n:20][cH:21][cH:22]3)[cH:16]2)[CH2:12][CH2:13]1