Ethyl 2-[6-{1-[(1,1-dimethylethyl)(dimethyl)silyl]-1H-indol-4-yl}-1-(phenylsulfonyl)-1H-indazol-4-yl]-1,3-oxazole-5-carboxylate 分子结构式
HCID59564707

Ethyl 2-[6-{1-[(1,1-dimethylethyl)(dimethyl)silyl]-1H-indol-4-yl}-1-(phenylsulfonyl)-1H-indazol-4-yl]-1,3-oxazole-5-carboxylate

ethyl 2-[1-(benzenesulfonyl)-6-[1-[tert-butyl(dimethyl)silyl]indol-4-yl]indazol-4-yl]-1,3-oxazole-5-carboxylate

C33H34N4O5SSi626.8 g/mol

IDENTITY

结构与身份

标准SMILES
CCOC(=O)c1cnc(-c2cc(-c3cccc4c3ccn4[Si](C)(C)C(C)(C)C)cc3c2cnn3S(=O)(=O)c2ccccc2)o1
InChIKey
GJPSLYALDKYIHN-UHFFFAOYSA-N
分子式
C33H34N4O5SSi
平均分子量
626.8 g/mol
单同位素质量
626.20191791

COMPUTED

结构计算性质

已同步
极性表面积
118 Ų
氢键供体
0
氢键受体
7
可旋转键
9
重原子
44
形式电荷
0
复杂度
1,140

ALIASES

名称与别名

共 7 条
ethyl 2-[6-(1-[(1,1-dimethylethyl)(dimethyl)silyl]-1H-indol-4-yl)-1-(phenylsulfonyl)-1H-indazol-4-yl]-1,3-oxazole-5-carboxylateEthyl 2-[6-{1-[(1,1-dimethylethyl)(dimethyl)silyl]-1H-indol-4-yl}-1-(phenylsulfonyl)-1H-indazol-4-yl]-1,3-oxazole-5-carboxylateSCHEMBL111404GJPSLYALDKYIHN-UHFFFAOYSA-NDB-2027211254036-89-92-[6-[1-[(1,1-Dimethylethyl)dimethylsilyl]-1h-indol-4-yl]-1-(phenylsulfonyl)-1h-indazol-4-yl]-5-oxazolecarboxylic acid ethyl ester

REACTIONS

参与反应

15
HRID 111143 反应方程式

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

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HRID 520563 反应方程式

uspto-grants-2016_05 · 10.6084/m9.figshare.5104873.v1 · US09326987B2

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HRID 520564 反应方程式

uspto-grants-2016_05 · 10.6084/m9.figshare.5104873.v1 · US09326987B2

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HRID 1150706 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (7/10) · 10.1039/C8SC04228D

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HRID 1912327 反应方程式

uspto-grants-2013_12 · 10.6084/m9.figshare.5104873.v1 · US08609657B2

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HRID 1912328 反应方程式

uspto-grants-2013_12 · 10.6084/m9.figshare.5104873.v1 · US08609657B2

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HRID 2036058 反应方程式

uspto-grants-2013_11 · 10.6084/m9.figshare.5104873.v1 · US08575162B2

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HRID 2036059 反应方程式

uspto-grants-2013_11 · 10.6084/m9.figshare.5104873.v1 · US08575162B2

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