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结构：COc1ccc(CNc2ccc(C#N)cc2Nc2ncc([N+](=O)[O-])c(SC#N)n2)c(OC)c1
HCID56605211

2-(5-Cyano-2-{[(2,4-dimethoxyphenyl)methyl]amino}anilino)-5-nitropyrimidin-4-yl thiocyanate

C21H17N7O4S463.479 g/molCAS 911826-05-6
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IDENTITY

结构与身份

标准 SMILES
COc1ccc(CNc2ccc(C#N)cc2Nc2ncc([N+](=O)[O-])c(SC#N)n2)c(OC)c1
InChIKey
WEFUTXLXLCLWGK-UHFFFAOYSA-N
分子式
C21H17N7O4S
平均分子量
463.479 g/mol
单同位素质量
463.10627302
扩展信息尚未完成同步。

REACTIONS

参与反应

14 条
全部作为反应物作为生成物作为试剂作为催化剂作为溶剂
HRID113423

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

作为反应物
HRID 113423 方程式

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

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HRID115662

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

作为反应物
HRID 115662 方程式

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

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HRID175569

Training data from https://doi.org/10.1039/C8SC04228D (6/10)

作为反应物
HRID 175569 方程式

Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D

查看条件与参与物
HRID289962

Training data from https://doi.org/10.1039/C8SC04228D (8/10)

作为生成物
HRID 289962 方程式

Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D

查看条件与参与物