HRID292655

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID2736256

1,2-dimethyl-1H-imidazole-4-sulfonyl chloride

C5H7ClN2O2S

HCID67368864

未命名化合物

PRODUCTS

生成物

HCID313

Hydrochloric Acid

ClH

结构：Cc1nc(S(=O)(=O)N(C)CCN2CCN(c3nccnc3-c3ccccc3F)CC2)cn1C

HCID59252240

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-171119a9986c40fc8aede4fb0cd8e282
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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