Chem
J-GLOBAL ID：200907003681520553   Nikkaji number：J1.328.031B

Parecoxib sodium

パレコキシブナトリウム
Substance type：
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
Molecular formula： C19H17N2NaO4S
Molecular formula furigana： C19-H17-N2-NA-O4-S
Molecular weight： 392.400
InChI： InChI=1S/C19H18N2O4S.Na/c1-3-17(22)21-26(23,24)16-11-9-14(10-12-16)18-13(2)25-20-19(18)15-7-5-4-6-8-15;/h4-12H,3H2,1-2H3,(H,21,22);/q;+1/p-1
InChI key： HQPVVKXJNZEAFW-UHFFFAOYSA-M
SMILES： CCC(=O)N([Na])S(=O)(=O)c1ccc(cc1)c1c(C)onc1c1ccccc1
Systematic name  (3)：
  • N-ソジオ-N-プロパノイル-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
  • N-[4-(5-メチル-3-フェニル-1,2-オキサゾール-4-イル)ベンゼンスルホニル]-N-ソジオプロパンアミド
  • N-[4-(5-methyl-3-phenyl-1,2-oxazol-4-yl)benzenesulfonyl]-N-sodiopropanamide
Other name (3)：
  • N-Sodio-N-propanoyl-4-(3-phenyl-5-methylisoxazole-4-yl)benzenesulfonamide
  • パレコキシブナトリウム
  • Parecoxib sodium
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