Chem
J-GLOBAL ID：200907093432056625   Nikkaji number：J2.298.344J

Netupitant

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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： C30H32F6N4O
Molecular formula furigana： C30-H32-F6-N4-O
Molecular weight： 578.603
InChI： InChI=1S/C30H32F6N4O/c1-19-8-6-7-9-23(19)24-17-26(40-12-10-38(4)11-13-40)37-18-25(24)39(5)27(41)28(2,3)20-14-21(29(31,32)33)16-22(15-20)30(34,35)36/h6-9,14-18H,10-13H2,1-5H3
InChI key： WAXQNWCZJDTGBU-UHFFFAOYSA-N
SMILES： CN(C(=O)C(C)(C)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1cnc(cc1c1ccccc1C)N1CCN(C)CC1
Systematic name  (4)：
  • N-メチル-N-[4-(2-メチルフェニル)-6-(4-メチルピペラジノ)-3-ピリジニル]-2-メチル-2-[3,5-ビス(トリフルオロメチル)フェニル]プロパンアミド
  • N-メチル-N-[6-(4-メチルピペラジン-1-イル)-4-(2-メチルフェニル)ピリジン-3-イル]-2-[3,5-ビス(トリフルオロメチル)フェニル]-2-メチルプロパンアミド
  • 2-[3,5-ビス(トリフルオロメチル)フェニル]-N,2-ジメチル-N-[4-(2-メチルフェニル)-6-(4-メチルピペラジン-1-イル)ピリジン-3-イル]プロパンアミド
  • 2-[3,5-bis(trifluoromethyl)phenyl]-N,2-dimethyl-N-[4-(2-methylphenyl)-6-(4-methylpiperazin-1-yl)pyridin-3-yl]propanamide
Other name (7)：
  • N-Methyl-N-[4-(2-methylphenyl)-6-(4-methylpiperazino)-3-pyridinyl]-2-methyl-2-[3,5-bis(trifluoromethyl)phenyl]propanamide
  • N-Methyl-N-[6-(4-methylpiperazin-1-yl)-4-(2-methylphenyl)pyridin-3-yl]-2-[3,5-bis(trifluoromethyl)phenyl]-2-methylpropanamide
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  • Akynzeo
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CAS registry number： 290297-26-6
Application (1)：
antiemetic
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