Chem
J-GLOBAL ID:201507009458523881   Nikkaji number:J3.416.089I

(1S,3aR,6aS)-N-Butyl-2-[(5S)-5-cyclohexyl-5-[(pyrazine-2-ylcarbonyl)amino]-2-tert-butyl-4-oxopentanoyl]octahydrocyclopenta[c]pyrrole-1-carboxamide

(1S,3aR,6aS)-N-ブチル-2-[(5S)-5-シクロヘキシル-5-[(ピラジン-2-イルカルボニル)アミノ]-2-tert-ブチル-4-オキソペンタノイル]オクタヒドロシクロペンタ[c]ピロール-1-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: C32H49N5O4
Molecular formula furigana: C32-H49-N5-O4
Molecular weight: 567.775
InChI: InChI=1S/C32H49N5O4/c1-5-6-15-35-30(40)28-23-14-10-13-22(23)20-37(28)31(41)24(32(2,3)4)18-26(38)27(21-11-8-7-9-12-21)36-29(39)25-19-33-16-17-34-25/h16-17,19,21-24,27-28H,5-15,18,20H2,1-4H3,(H,35,40)(H,36,39)/t22-,23-,24?,27-,28-/m0/s1
InChI key: USNVYEURLJOMPD-NIZBHKDXSA-N
SMILES: CCCCNC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1C(=O)C(CC(=O)[C@@H](NC(=O)c1cnccn1)C1CCCCC1)C(C)(C)C
Systematic name  (3):
  • (1S,3aR,6aS)-N-ブチル-2-[(5S)-5-シクロヘキシル-5-[(ピラジン-2-イルカルボニル)アミノ]-2-tert-ブチル-4-オキソペンタノイル]オクタヒドロシクロペンタ[c]ピロール-1-カルボアミド
  • N-[(1S)-5-[(1S,3aR,6aS)-1-(ブチルカルバモイル)-オクタヒドロシクロペンタ[c]ピロール-2-イル]-4-tert-ブチル-1-シクロヘキシル-2,5-ジオキソペンチル]ピラジン-2-カルボキサミド
  • N-[(1S)-5-[(1S,3aR,6aS)-1-(butylcarbamoyl)-octahydrocyclopenta[c]pyrrol-2-yl]-4-tert-butyl-1-cyclohexyl-2,5-dioxopentyl]pyrazine-2-carboxamide
Other name (1):
  • (1S,3aR,6aS)-N-Butyl-2-[(5S)-5-cyclohexyl-5-[(pyrazine-2-ylcarbonyl)amino]-2-tert-butyl-4-oxopentanoyl]octahydrocyclopenta[c]pyrrole-1-carboxamide
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