Chem
J-GLOBAL ID：200907097122405790   Nikkaji number：J602.060G

1,3-Dipropyl-8-[[4-(fluorosulfonyl)benzoyl]amino]xanthine

1,3-ジプロピル-8-[[4-(フルオロスルホニル)ベンゾイル]アミノ]キサンチン
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： C18H20FN5O5S
Molecular formula furigana： C18-H20-F-N5-O5-S
Molecular weight： 437.450
InChI： InChI=1S/C18H20FN5O5S/c1-3-9-23-14-13(16(26)24(10-4-2)18(23)27)20-17(21-14)22-15(25)11-5-7-12(8-6-11)30(19,28)29/h5-8H,3-4,9-10H2,1-2H3,(H2,20,21,22,25)
InChI key： MJXSWDVTVSUXNH-UHFFFAOYSA-N
SMILES： CCCn1c2nc(NC(=O)c3ccc(cc3)S(=O)(=O)F)[nH]c2c(=O)n(CCC)c1=O
Systematic name  (3)：
  • 1,3-ジプロピル-8-[[4-(フルオロスルホニル)ベンゾイル]アミノ]キサンチン
  • 4-[(2,6-ジオキソ-1,3-ジプロピル-2,3,6,7-テトラヒドロ-1H-プリン-8-イル)カルバモイル]ベンゼン-1-スルホニル フルオリド
  • 4-[(2,6-dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-yl)carbamoyl]benzene-1-sulfonyl fluoride
Other name (1)：
  • 1,3-Dipropyl-8-[[4-(fluorosulfonyl)benzoyl]amino]xanthine
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