Chem
J-GLOBAL ID：201107039571787697   Nikkaji number：J2.941.689C

ABT-341

7-[[4α-(2,4,5-トリフルオロフェニル)-5β-アミノ-1-シクロヘキセニル]カルボニル]-3-(トリフルオロメチル)-5,6,7,8-テトラヒドロ-1,2,4-トリアゾロ[4,3-a]ピラジン
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： C19H17F6N5O
Molecular formula furigana： C19-H17-F6-N5-O
Molecular weight： 445.369
InChI： InChI=1S/C19H17F6N5O/c20-12-7-14(22)13(21)6-11(12)10-2-1-9(5-15(10)26)17(31)29-3-4-30-16(8-29)27-28-18(30)19(23,24)25/h1,6-7,10,15H,2-5,8,26H2/t10-,15+/m1/s1
InChI key： NVVSPGQEXMJZIR-BMIGLBTASA-N
SMILES： N[C@H]1CC(=CC[C@@H]1c1cc(F)c(F)cc1F)C(=O)N1CCn2c(C1)nnc2C(F)(F)F
Systematic name  (3)：
  • 7-[[4α-(2,4,5-トリフルオロフェニル)-5β-アミノ-1-シクロヘキセニル]カルボニル]-3-(トリフルオロメチル)-5,6,7,8-テトラヒドロ-1,2,4-トリアゾロ[4,3-a]ピラジン
  • (1S,6R)-3-[3-(トリフルオロメチル)-5H,6H,7H,8H-[1,2,4]トリアゾロ[4,3-a]ピラジン-7-カルボニル]-6-(2,4,5-トリフルオロフェニル)シクロヘキサ-3-エン-1-アミン
  • (1S,6R)-3-[3-(trifluoromethyl)-5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyrazine-7-carbonyl]-6-(2,4,5-trifluorophenyl)cyclohex-3-en-1-amine
Other name (2)：
  • 7-[[4α-(2,4,5-Trifluorophenyl)-5β-amino-1-cyclohexenyl]carbonyl]-3-(trifluoromethyl)-5,6,7,8-tetrahydro-1,2,4-triazolo[4,3-a]pyrazine
  • ABT-341
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