HRID957734

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID813

Potassium cation

K+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID30165

Iodide ion

I-

HCID81531

Diisopropylethylamine

C8H19N

HCID594590

1H-Indole, 4-(1-piperazinyl)-

C12H15N3

HCID19968360

未命名化合物

PRODUCTS

生成物

结构：O=C(C(CCN1CCN(c2cccc3[nH]ccc23)CC1)c1ccccc1)N1C2CCCC1CC2

HCID19968364

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7caf41ab5c34475281cd31ce0f87d6bc
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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