Chem
J-GLOBAL ID：200907019133521103   Nikkaji number：J1.153.112A

ML-1785713

ML-1785713
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： C17H20O5S
Molecular formula furigana： C17-H20-O5-S
Molecular weight： 336.400
InChI： InChI=1S/C17H20O5S/c1-17(2)14(12-6-8-13(9-7-12)23(3,19)20)15(16(18)22-17)21-10-11-4-5-11/h6-9,11H,4-5,10H2,1-3H3
InChI key： FULAPETWGIGNMT-UHFFFAOYSA-N
SMILES： CC1(C)OC(=O)C(=C1c1ccc(cc1)S(=O)(=O)C)OCC1CC1
Systematic name  (4)：
  • 3-(シクロプロピルメトキシ)-4-[4-(メチルスルホニル)フェニル]-5,5-ジメチル-2,5-ジヒドロフラン-2-オン
  • 3-(シクロプロピルメトキシ)-5,5-ジメチル-4-[4-(メチルスルホニル)フェニル]フラン-2(5H)-オン
  • 3-(シクロプロピルメトキシ)-4-(4-メタンスルホニルフェニル)-5,5-ジメチル-2,5-ジヒドロフラン-2-オン
  • 3-(cyclopropylmethoxy)-4-(4-methanesulfonylphenyl)-5,5-dimethyl-2,5-dihydrofuran-2-one
Other name (5)：
  • 3-(Cyclopropylmethoxy)-4-[4-(methylsulfonyl)phenyl]-5,5-dimethyl-2,5-dihydrofuran-2-one
  • 3-(Cyclopropylmethoxy)-5,5-dimethyl-4-[4-(methylsulfonyl)phenyl]furan-2(5H)-one
  • Firocoxib
  • フィロコキシブ
  • ML-1785713
CAS registry number： 189954-96-9
KEGG DRUG： D03712
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM