Chem
J-GLOBAL ID：200907053432573059
Nikkaji number：J1.302.764A
Valdecoxib
バルデコキシブ
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C16H14N2O3S
Molecular formula furigana： C16-H14-N2-O3-S
Molecular weight： 314.360
InChI：
InChI=1S/C16H14N2O3S/c1-11-15(12-7-9-14(10-8-12)22(17,19)20)16(18-21-11)13-5-3-2-4-6-13/h2-10H,1H3,(H2,17,19,20)
InChI key：
LNPDTQAFDNKSHK-UHFFFAOYSA-N
SMILES：
Cc1onc(c1c1ccc(cc1)S(=O)(=O)N)c1ccccc1
Systematic name (6)：
- 4-[3-フェニル-5-メチルイソオキサゾール-4-イル]ベンゼンスルホンアミド
- 4-(3-フェニル-5-メチルイソオキサゾール-4-イル)ベンゼンスルホンアミド
- 4-(3-フェニル-5-メチル-4-イソオキサゾリル)ベンゼンスルホンアミド
- 3-フェニル-4-(4-スルファモイルフェニル)-5-メチルイソオキサゾール
- 4-(5-メチル-3-フェニル-1,2-オキサゾール-4-イル)ベンゼン-1-スルホンアミド
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- 4-[3-Phenyl-5-methylisoxazole-4-yl]benzenesulfonamide
- 4-(3-Phenyl-5-methylisoxazole-4-yl)benzenesulfonamide
- バルデコキシブ
- Valdecoxib
- 4-(3-Phenyl-5-methyl-4-isoxazolyl)benzenesulfonamide
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