HRID161133

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6422

Trifluoroacetic acid

C2HF3O2

HCID438968

Morpholin-4-yl-acetic acid

C6H11NO3

HCID9997668

[4-Amino-2-(piperidin-4-ylamino)-pyrimidin-5-yl]-(5-fluoro-2-methoxy-phenyl)-methanone

C17H20FN5O2

PRODUCTS

产物

HCID10479926

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-b2f0d5d06e60491c9ef3b4af97d141c1
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应SMILES

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