HRID86309

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID88638

Benzimidazolone

C12H15N3O

HCID14580026

未命名化合物

PRODUCTS

生成物

结构：O=c1[nH]c2ccccc2n1C1CCN(CCCN2c3cccc4cccc(c34)S2(=O)=O)CC1

HCID15710727

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6b23574603f9431ea1b05d0d3995fbad
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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