Chem
J-GLOBAL ID:201407087440730025   Nikkaji number:J3.233.697C

NVP-QAV680

1-[4-(メチルスルホニル)ベンジル]-2-メチル-1H-ピロロ[2,3-b]ピリジン-3-酢酸
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: C18H18N2O4S
Molecular formula furigana: C18-H18-N2-O4-S
Molecular weight: 358.410
InChI: InChI=1S/C18H18N2O4S/c1-12-16(10-17(21)22)15-4-3-9-19-18(15)20(12)11-13-5-7-14(8-6-13)25(2,23)24/h3-9H,10-11H2,1-2H3,(H,21,22)
InChI key: YOPFAMROKXHVCQ-UHFFFAOYSA-N
SMILES: Cc1c(CC(=O)O)c2cccnc2n1Cc1ccc(cc1)S(=O)(=O)C
Systematic name  (3):
  • 1-[4-(メチルスルホニル)ベンジル]-2-メチル-1H-ピロロ[2,3-b]ピリジン-3-酢酸
  • 2-{1-[(4-メタンスルホニルフェニル)メチル]-2-メチル-1H-ピロロ[2,3-b]ピリジン-3-イル}酢酸
  • 2-{1-[(4-methanesulfonylphenyl)methyl]-2-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl}acetic acid
Other name (2):
  • 1-[4-(Methylsulfonyl)benzyl]-2-methyl-1H-pyrrolo[2,3-b]pyridine-3-acetic acid
  • NVP-QAV680
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