HCID20557694

N-ethyl-N'-[2-((4-methyl-5-oxazolyl)methylthio)ethyl]thiourea

1-ethyl-3-[2-[(4-methyl-1,3-oxazol-5-yl)methylsulfanyl]ethyl]thiourea

C10H17N3OS2259.4 g/mol

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IDENTITY

结构与身份

标准SMILES: CCNC(=S)NCCSCc1ocnc1C
InChIKey: JCEUZGAEBLLDMK-UHFFFAOYSA-N
分子式: C10H17N3OS2
平均分子量: 259.4 g/mol
单同位素质量: 259.08130452

COMPUTED

结构计算性质

已同步

XLogP: 1.3
极性表面积: 107 Å²
氢键供体: 2
氢键受体: 4
可旋转键: 6
重原子: 16
形式电荷: 0
复杂度: 216

ALIASES

名称与别名

共 5 条

SCHEMBL11322306JCEUZGAEBLLDMK-UHFFFAOYSA-NN-ethyl-N'-[2-((4-methyl-5-oxazolyl)methylthio)ethyl]thioureaN-ethyl-N'-[2-((4-methyl-5-oxazolyl)-methylthio)ethyl]thioureaN-ethyl-N'-[2-((4-methyl-5-oxazolyl)methylthio) ethyl]thiourea

REACTIONS

参与反应

11 条

uspto-grants-1979_04 · 10.6084/m9.figshare.5104873.v1 · US04151288

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uspto-grants-1977_04 · 10.6084/m9.figshare.5104873.v1 · US04018931

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uspto-grants-1981_10 · 10.6084/m9.figshare.5104873.v1 · US04293697

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uspto-grants-1980_10 · 10.6084/m9.figshare.5104873.v1 · US04226874

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uspto-grants-1980_10 · 10.6084/m9.figshare.5104873.v1 · US04230865

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uspto-grants-1977_10 · 10.6084/m9.figshare.5104873.v1 · US04053473

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Training data from https://doi.org/10.1039/C8SC04228D (5/10) · 10.1039/C8SC04228D

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uspto-grants-1976_04 · 10.6084/m9.figshare.5104873.v1 · US03950353

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