HRID816134

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID46838760

3-Ethynylimidazo[1,2-b]pyridazine

C8H5N3

结构：Cc1ccc(C(=O)Nc2ccc(CN3CCN(CCO)CC3)c(C(F)(F)F)c2)cc1I

HCID66736595

N-[4-[[4-(2-Hydroxyethyl)-1-piperazinyl]methyl]-3-(trifluoromethyl)phenyl]-3-iodo-4-methylbenzamide

C22H25F3IN3O2

PRODUCTS

生成物

结构：Cc1ccc(C(=O)Nc2ccc(CN3CCN(CCO)CC3)c(C(F)(F)F)c2)cc1C#Cc1cnc2cccnn12

HCID24826879

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-74400b79e88e4f02bc7132a864236d34
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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