HRID181013

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1533

4-Methylpyridin-2-amine

C6H8N2

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID9886

Hexafluorophosphate ion

F6P-

HCID130500

未命名化合物

HCID853753

Thymine-1-acetic acid

C7H8N2O4

PRODUCTS

生成物

结构：Cc1ccnc(NC(=O)Cn2cc(C)c(=O)[nH]c2=O)c1

HCID24745170

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-63e1287cd9934a1ea6b3e711d0605746
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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