HCID54202552

2-Allyloxyimino-2-(2-formamidothiazol-4-yl)acetic acid

2-(2-formamido-1,3-thiazol-4-yl)-2-prop-2-enoxyiminoacetic acid

C9H9N3O4S255.25 g/mol

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IDENTITY

结构与身份

标准SMILES: C=CCON=C(C(=O)O)c1csc(NC=O)n1
InChIKey: PQGZZWPUWOSNOK-UHFFFAOYSA-N
分子式: C9H9N3O4S
平均分子量: 255.25 g/mol
单同位素质量: 255.03137695

COMPUTED

结构计算性质

已同步

XLogP: 1.4
极性表面积: 129 Å²
氢键供体: 2
氢键受体: 7
可旋转键: 6
重原子: 17
形式电荷: 0
复杂度: 334

ALIASES

名称与别名

共 5 条

SCHEMBL9481491PQGZZWPUWOSNOK-UHFFFAOYSA-N2-(2-Formamidothiazol-4-yl)-2-allyloxyiminoacetic acid2-allyloxyimino-2-(2-formamidothiazol-4-yl)acetic acid2-allyloxyimino-2-(2-formylaminothiazol-4-yl)acetic acid

REACTIONS

参与反应

12 条

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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uspto-grants-1983_12 · 10.6084/m9.figshare.5104873.v1 · US04420477

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uspto-grants-1986_04 · 10.6084/m9.figshare.5104873.v1 · US04582908

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uspto-grants-1981_12 · 10.6084/m9.figshare.5104873.v1 · US04304770

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uspto-grants-1981_12 · 10.6084/m9.figshare.5104873.v1 · US04304770

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uspto-grants-1981_12 · 10.6084/m9.figshare.5104873.v1 · US04304770

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uspto-grants-1981_12 · 10.6084/m9.figshare.5104873.v1 · US04305937

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uspto-grants-1986_11 · 10.6084/m9.figshare.5104873.v1 · US04622318

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