Chem
J-GLOBAL ID:200907091835693789   Nikkaji number:J1.764.489K

2-[2-Hydroxy-3-[[(1S)-2β-methylcyclohexane-1α-yl]oxy]phenyl]-6-fluoro-1H-benzimidazole-5-carboxamidine

2-[2-ヒドロキシ-3-[[(1S)-2β-メチルシクロヘキサン-1α-イル]オキシ]フェニル]-6-フルオロ-1H-ベンゾイミダゾール-5-カルボアミジン
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: C21H23FN4O2
Molecular formula furigana: C21-H23-F-N4-O2
Molecular weight: 382.439
InChI: InChI=1S/C21H23FN4O2/c1-11-5-2-3-7-17(11)28-18-8-4-6-12(19(18)27)21-25-15-9-13(20(23)24)14(22)10-16(15)26-21/h4,6,8-11,17,27H,2-3,5,7H2,1H3,(H3,23,24)(H,25,26)/t11-,17-/m0/s1
InChI key: CMCDWLMEDRBWIR-GTNSWQLSSA-N
SMILES: C[C@H]1CCCC[C@@H]1Oc1cccc(c2nc3cc(C(=N)N)c(F)cc3[nH]2)c1O
Systematic name  (3):
  • 2-[2-ヒドロキシ-3-[[(1S)-2β-メチルシクロヘキサン-1α-イル]オキシ]フェニル]-6-フルオロ-1H-ベンゾイミダゾール-5-カルボアミジン
  • 6-フルオロ-2-(2-ヒドロキシ-3-{[(1S,2S)-2-メチルシクロヘキシル]オキシ}フェニル)-1H-1,3-ベンゾジアゾール-5-カルボキシミドアミド
  • 6-fluoro-2-(2-hydroxy-3-{[(1S,2S)-2-methylcyclohexyl]oxy}phenyl)-1H-1,3-benzodiazole-5-carboximidamide
Other name (1):
  • 2-[2-Hydroxy-3-[[(1S)-2β-methylcyclohexane-1α-yl]oxy]phenyl]-6-fluoro-1H-benzimidazole-5-carboxamidine
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