HRID1219658

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID962

Water

H2O

HCID6775

2,3-Dichloro-5,6-dicyano-p-benzoquinone

C8Cl2N2O2

HCID8028

Tetrahydrofuran

C4H8O

HCID8030

Thiophene

C4H4S

HCID8058

n-Hexane

C6H14

HCID21979554

4,6-Dichloro-5-(4-methylphenyl)pyrimidine

C11H8Cl2N2

HCID178418339

未命名化合物

PRODUCTS

生成物

HCID19689504

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1c9df6c1b4c345aabdc9698f3e2d8e5d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[CH2:12]([Li:13])[CH2:14][CH2:15][CH3:16].[CH3:17][c:18]1[cH:19][cH:20][c:21](-[c:24]2[c:25]([Cl:31])[n:26][cH:27][n:28][c:29]2[Cl:30])[cH:22][cH:23]1.[CH3:52][C:53](=[O:54])[OH:55].[CH3:6][CH2:7][CH2:8][CH2:9][CH2:10][CH3:11].[Cl:32][C:33]1=[C:44]([Cl:45])[C:42](=[O:43])[C:39]([C:40]#[N:41])=[C:36]([C:37]#[N:38])[C:34]1=[O:35].[O:46]1[CH2:47][CH2:48][CH2:49][CH2:50]1.[OH2:51].[cH:1]1[cH:2][cH:3][s:4][cH:5]1>>[cH:1]1[cH:2][c:3](-[c:27]2[n:26][c:25]([Cl:31])[c:24](-[c:21]3[cH:20][cH:19][c:18]([CH3:17])[cH:23][cH:22]3)[c:29]([Cl:30])[n:28]2)[s:4][cH:5]1