Chem
J-GLOBAL ID：201007015307264496   Nikkaji number：J2.870.988I

Vemurafenib

ベムラフェニブ
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： C23H18ClF2N3O3S
Molecular formula furigana： C23-H18-CL-F2-N3-O3-S
Molecular weight： 489.920
InChI： InChI=1S/C23H18ClF2N3O3S/c1-2-9-33(31,32)29-19-8-7-18(25)20(21(19)26)22(30)17-12-28-23-16(17)10-14(11-27-23)13-3-5-15(24)6-4-13/h3-8,10-12,29H,2,9H2,1H3,(H,27,28)
InChI key： GPXBXXGIAQBQNI-UHFFFAOYSA-N
SMILES： CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(cc23)c2ccc(Cl)cc2)c1F
Systematic name  (5)：
  • 3-[3-[(プロピルスルホニル)アミノ]-2,6-ジフルオロベンゾイル]-5-(4-クロロフェニル)-1H-ピロロ[2,3-b]ピリジン
  • N-[2,4-ジフルオロ-3-[5-(4-クロロフェニル)-1H-ピロロ[2,3-b]ピリジン-3-イルカルボニル]フェニル]-1-プロパンスルホンアミド
  • 5-(4-クロロフェニル)-3-[3-[(プロピルスルホニル)アミノ]-2,6-ジフルオロベンゾイル]-1H-ピロロ[2,3-b]ピリジン
  • N-{3-[5-(4-クロロフェニル)-1H-ピロロ[2,3-b]ピリジン-3-カルボニル]-2,4-ジフルオロフェニル}プロパン-1-スルホンアミド
  • N-{3-[5-(4-chlorophenyl)-1H-pyrrolo[2,3-b]pyridine-3-carbonyl]-2,4-difluorophenyl}propane-1-sulfonamide
Other name (7)：
  • 3-[3-[(Propylsulfonyl)amino]-2,6-difluorobenzoyl]-5-(4-chlorophenyl)-1H-pyrrolo[2,3-b]pyridine
  • PLX-4032
  • Vemurafenib
  • ベムラフェニブ
  • Ro-51-85426
Show all
CAS registry number： 918504-65-1
Application (1)：
antitumor drug
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