Chem
J-GLOBAL ID：200907062972968442   Nikkaji number：J2.034.320F

ω-(1-Propyl-2,6-dioxo-8-cyclohexyl-2,3,6,7-tetrahydro-1H-purine-3-yl)-4′-(fluorosulfonyl)valerophenone

ω-(1-プロピル-2,6-ジオキソ-8-シクロヘキシル-2,3,6,7-テトラヒドロ-1H-プリン-3-イル)-4′-(フルオロスルホニル)バレロフェノン
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： C25H31FN4O5S
Molecular formula furigana： C25-H31-F-N4-O5-S
Molecular weight： 518.600
InChI： InChI=1S/C25H31FN4O5S/c1-2-15-30-24(32)21-23(28-22(27-21)18-8-4-3-5-9-18)29(25(30)33)16-7-6-10-20(31)17-11-13-19(14-12-17)36(26,34)35/h11-14,18H,2-10,15-16H2,1H3,(H,27,28)
InChI key： AHPJUSSESRHGJN-UHFFFAOYSA-N
SMILES： CCCn1c(=O)n(CCCCC(=O)c2ccc(cc2)S(=O)(=O)F)c2nc([nH]c2c1=O)C1CCCCC1
Systematic name  (3)：
  • ω-(1-プロピル-2,6-ジオキソ-8-シクロヘキシル-2,3,6,7-テトラヒドロ-1H-プリン-3-イル)-4′-(フルオロスルホニル)バレロフェノン
  • 4-[5-(8-シクロヘキシル-2,6-ジオキソ-1-プロピル-2,3,6,7-テトラヒドロ-1H-プリン-3-イル)ペンタノイル]ベンゼン-1-スルホニル フルオリド
  • 4-[5-(8-cyclohexyl-2,6-dioxo-1-propyl-2,3,6,7-tetrahydro-1H-purin-3-yl)pentanoyl]benzene-1-sulfonyl fluoride
Other name (1)：
  • ω-(1-Propyl-2,6-dioxo-8-cyclohexyl-2,3,6,7-tetrahydro-1H-purine-3-yl)-4′-(fluorosulfonyl)valerophenone
Thsaurus map：
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