Chem
J-GLOBAL ID：201207001773724840   Nikkaji number：J3.025.737E

2-(Butylamino)-1-(4-fluorobenzyl)-4-[3-methoxy-4-(4-methyl-1H-imidazole-1-yl)benzylidene]-1H-imidazole-5(4H)-one

2-(ブチルアミノ)-1-(4-フルオロベンジル)-4-[3-メトキシ-4-(4-メチル-1H-イミダゾール-1-イル)ベンジリデン]-1H-イミダゾール-5(4H)-オン
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： C26H28FN5O2
Molecular formula furigana： C26-H28-F-N5-O2
Molecular weight： 461.541
InChI： InChI=1S/C26H28FN5O2/c1-4-5-12-28-26-30-22(25(33)32(26)16-19-6-9-21(27)10-7-19)13-20-8-11-23(24(14-20)34-3)31-15-18(2)29-17-31/h6-11,13-15,17H,4-5,12,16H2,1-3H3,(H,28,30)
InChI key： LGIDSVCNVDQXNT-UHFFFAOYSA-N
SMILES： CCCCNC1=NC(=Cc2ccc(c(OC)c2)n2cnc(C)c2)C(=O)N1Cc1ccc(F)cc1
Systematic name  (3)：
  • 2-(ブチルアミノ)-1-(4-フルオロベンジル)-4-[3-メトキシ-4-(4-メチル-1H-イミダゾール-1-イル)ベンジリデン]-1H-イミダゾール-5(4H)-オン
  • 2-(ブチルアミノ)-1-[(4-フルオロフェニル)メチル]-4-{[3-メトキシ-4-(4-メチル-1H-イミダゾール-1-イル)フェニル]メチリデン}-4,5-ジヒドロ-1H-イミダゾール-5-オン
  • 2-(butylamino)-1-[(4-fluorophenyl)methyl]-4-{[3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl]methylidene}-4,5-dihydro-1H-imidazol-5-one
Other name (1)：
  • 2-(Butylamino)-1-(4-fluorobenzyl)-4-[3-methoxy-4-(4-methyl-1H-imidazole-1-yl)benzylidene]-1H-imidazole-5(4H)-one
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