HRID138109

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID14210620

未命名化合物

HCID53407084

1,5-Diphenyl-1H-pyrazole-3-carbaldehyde

C16H12N2O

PRODUCTS

生成物

结构：Clc1ccc(C(c2ccccc2)N2CCN(CCNCc3cc(-c4ccccc4)n(-c4ccccc4)n3)CC2)cc1

HCID68975887

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b499428f0ec843eab63455f0297967bd
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

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