Chem
J-GLOBAL ID：201707020920486197   Nikkaji number：J3.591.555I

N-(2,4-Dimethylphenyl)-3α-[5-[3β-(2-methylpropyl)cyclobutane-1β-yl]-4-cyclopropyl-4H-1,2,4-triazole-3-yl]-1-acetylpyrrolidine-4β-carboxamide

N-(2,4-ジメチルフェニル)-3α-[5-[3β-(2-メチルプロピル)シクロブタン-1β-イル]-4-シクロプロピル-4H-1,2,4-トリアゾール-3-イル]-1-アセチルピロリジン-4β-カルボアミド
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： C28H39N5O2
Molecular formula furigana： C28-H39-N5-O2
Molecular weight： 477.653
InChI： InChI=1S/C28H39N5O2/c1-16(2)10-20-12-21(13-20)26-30-31-27(33(26)22-7-8-22)23-14-32(19(5)34)15-24(23)28(35)29-25-9-6-17(3)11-18(25)4/h6,9,11,16,20-24H,7-8,10,12-15H2,1-5H3,(H,29,35)/t20-,21+,23-,24-/m0/s1
InChI key： NRAQMBSBKYAKMR-DVKRWUGUSA-N
SMILES： CC(C)C[C@H]1C[C@H](C1)c1nnc([C@H]2CN(C[C@@H]2C(=O)Nc2ccc(C)cc2C)C(=O)C)n1C1CC1
Systematic name  (4)：
  • N-(2,4-ジメチルフェニル)-3α-[5-[3β-(2-メチルプロピル)シクロブタン-1β-イル]-4-シクロプロピル-4H-1,2,4-トリアゾール-3-イル]-1-アセチルピロリジン-4β-カルボアミド
  • (3R)-N-(2,4-ジメチルフェニル)-1-アセチル-4β-[4-シクロプロピル-5-[3β-(2-メチルプロピル)シクロブタン-1β-イル]-4H-1,2,4-トリアゾール-3-イル]ピロリジン-3α-カルボアミド
  • (3R,4R)-1-アセチル-4-{4-シクロプロピル-5-[(1r,3s)-3-(2-メチルプロピル)シクロブチル]-4H-1,2,4-トリアゾール-3-イル}-N-(2,4-ジメチルフェニル)ピロリジン-3-カルボキサミド
  • (3R,4R)-1-acetyl-4-{4-cyclopropyl-5-[(1r,3s)-3-(2-methylpropyl)cyclobutyl]-4H-1,2,4-triazol-3-yl}-N-(2,4-dimethylphenyl)pyrrolidine-3-carboxamide
Other name (2)：
  • N-(2,4-Dimethylphenyl)-3α-[5-[3β-(2-methylpropyl)cyclobutane-1β-yl]-4-cyclopropyl-4H-1,2,4-triazole-3-yl]-1-acetylpyrrolidine-4β-carboxamide
  • (3R)-N-(2,4-Dimethylphenyl)-1-acetyl-4β-[4-cyclopropyl-5-[3β-(2-methylpropyl)cyclobutane-1β-yl]-4H-1,2,4-triazole-3-yl]pyrrolidine-3α-carboxamide
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