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【结 构 式】

【分子编号】22156

【品名】N-[(E)-1-(methylsulfanyl)-2-nitroethenyl]cyclohexanamine; N-cyclohexyl-N-[(E)-1-(methylsulfanyl)-2-nitroethenyl]amine

【CA登记号】

【 分 子 式 】C9H16N2O2S

【 分 子 量 】216.30432

【元素组成】C 49.98% H 7.46% N 12.95% O 14.79% S 14.82%

与该中间体有关的原料药合成路线共 1 条

合成路线1

该中间体在本合成路线中的序号:(VI)

Condensation of chloropyridine (I) with cyclooctylamine (II) provided the cyclooctylaminopyridine (III). The aminonitroethylene derivative (VI) was prepared by reaction of 1,1-bis(methylsulfanyl)-2-nitroethylene (IV) with cyclohexylamine (V) in refluxing EtOH. Subsequent condensation of this intermediate with the sodium salt of sulfonamide (III) yielded the title compound.

1 Masereel, B.; Wouters, J.; Pochet, L.; Lambert, D.; Design, synthesis, and anticonvulsant activity of 1-(pyrid-3-ylsulfonamido)-2-nitroethylenes. J Med Chem 1998, 41, 17, 3239.
中间体序号 中间体编号 品名 CAS号 分子式 供应商 用于合成
(I) 22151 4-chloro-3-pyridinesulfonamide C5H5ClN2O2S 详情 详情
(II) 17996 3-(1H-pyrazol-5-yl)benzaldehyde C10H8N2O 详情 详情
(II) 22152 cyclooctanamine; cyclooctylamine 5452-37-9 C8H17N 详情 详情
(III) 22153 4-(cyclooctylamino)-3-pyridinesulfonamide C13H21N3O2S 详情 详情
(VI) 13853 Methyl 1-(methylsulfanyl)-2-nitrovinyl sulfide; 1,1-Bis(methylthio)-2-nitroethylene; 1,1-Bis(methylsulfanyl)-2-nitroethylene 13623-94-4 C4H7NO2S2 详情 详情
(VI) 22156 N-[(E)-1-(methylsulfanyl)-2-nitroethenyl]cyclohexanamine; N-cyclohexyl-N-[(E)-1-(methylsulfanyl)-2-nitroethenyl]amine C9H16N2O2S 详情 详情
Extended Information