HRID147007

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3776

Isopropanol

C3H8O

HCID6422

Trifluoroacetic acid

C2HF3O2

HCID138828

Imidazo(1,2-b)pyridazine, 6-chloro-

C6H4ClN3

HCID66746656

未命名化合物

PRODUCTS

产物

HCID66746209

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-9f79c0b9b77140d0b628943c217587f7
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

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