HRID945100

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

HCID81531

Diisopropylethylamine

C8H19N

HCID3164136

Pyridine-3-sulfonyl chloride

C5H4ClNO2S

HCID54117491

Methyl 7-[[(4-butylphenyl)methyl]amino]heptanoate

C19H31NO2

PRODUCTS

生成物

结构：CCCCc1ccc(CN(CCCCCCC(=O)OC)S(=O)(=O)c2cccnc2)cc1

HCID53861461

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d1fa2aae8ab44891a6b41282e62444bc
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

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