HRID191588

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID76257

Diethylphosphorocyanidate

C5H10NO3P

HCID81531

Diisopropylethylamine

C8H19N

HCID10679695

1-(Propan-2-yl)-1H-indazole-3-carboxylic acid

C11H12N2O2

HCID67270797

未命名化合物

PRODUCTS

生成物

结构：CC(C)n1nc(C(=O)NC2CCC(CCO)N(Cc3ccccc3)C2)c2ccccc21

HCID67270876

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-dc2f88c5fc9a4dcd964c992e82e7ba7d
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

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