Chem
J-GLOBAL ID:200907013307531369
Nikkaji number:J2.533.443D
Taranabant
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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:
C27 H25 ClF3 N3 O2
Molecular formula furigana:
C27-H25-CL-F3-N3-O2
Molecular weight:
515.960
InChI:
InChI=1S/C27H25ClF3N3O2/c1-17(34-25(35)26(2,3)36-24-12-9-21(16-33-24)27(29,30)31)23(14-18-7-10-22(28)11-8-18)20-6-4-5-19(13-20)15-32/h4-13,16-17,23H,14H2,1-3H3,(H,34,35)/t17-,23+/m0/s1
InChI key:
QLYKJCMUNUWAGO-GAJHUEQPSA-N
SMILES:
C[C@H](NC(=O)C(C)(C)Oc1ccc(cn1)C(F)(F)F)[C@@H](Cc1ccc(Cl)cc1)c1cccc(c1)C#N
Systematic name (3):
N-[(1S,2S)-1-メチル-2-(3-シアノフェニル)-3-(4-クロロフェニル)プロピル]-2-[5-(トリフルオロメチル)-2-ピリジルオキシ]-2-メチルプロパンアミド
N-[(2S,3S)-4-(4-クロロフェニル)-3-(3-シアノフェニル)ブタン-2-イル]-2-メチル-2-{[5-(トリフルオロメチル)ピリジン-2-イル]オキシ}プロパンアミド
N-[(2S,3S)-4-(4-chlorophenyl)-3-(3-cyanophenyl)butan-2-yl]-2-methyl-2-{[5-(trifluoromethyl)pyridin-2-yl]oxy}propanamide
Other name (3):
N-[(1S,2S)-1-Methyl-2-(3-cyanophenyl)-3-(4-chlorophenyl)propyl]-2-[5-(trifluoromethyl)-2-pyridyloxy]-2-methylpropanamide
タラナバント
Taranabant
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