HRID320800

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID263

1-Butanol

C4H10O

HCID8471

Triethylamine

C6H15N

HCID80008

Ethyl 4-chloro-2-methylthio-5-pyrimidinecarboxylate

C8H9ClN2O2S

HCID25222875

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)CCN(c1ccc2c(c1)CCC2)c1nc(SC)ncc1C(=O)OCC

HCID25222876

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ff759c777b0844b4a17dbe2d0d33218b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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