Chem
J-GLOBAL ID：201607009255643242   Nikkaji number：J3.498.905B

VFU-13524

4,5-ジヒドロ-3-[4-メトキシ-3-[4-[4-(1H-テトラゾール-5-イル)フェノキシ]ブトキシ]フェニル]-4,4-ジメチル-1-イソプロピル-1H-ピラゾール-5-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： C26H32N6O4
Molecular formula furigana： C26-H32-N6-O4
Molecular weight： 492.580
InChI： InChI=1S/C26H32N6O4/c1-17(2)32-25(33)26(3,4)23(29-32)19-10-13-21(34-5)22(16-19)36-15-7-6-14-35-20-11-8-18(9-12-20)24-27-30-31-28-24/h8-13,16-17H,6-7,14-15H2,1-5H3,(H,27,28,30,31)
InChI key： LSMMVMRAIOYJHV-UHFFFAOYSA-N
SMILES： COc1ccc(cc1OCCCCOc1ccc(cc1)c1nnn[nH]1)C1=NN(C(C)C)C(=O)C1(C)C
Systematic name  (3)：
  • 4,5-ジヒドロ-3-[4-メトキシ-3-[4-[4-(1H-テトラゾール-5-イル)フェノキシ]ブトキシ]フェニル]-4,4-ジメチル-1-イソプロピル-1H-ピラゾール-5-オン
  • 3-(4-メトキシ-3-{4-[4-(1H-1,2,3,4-テトラゾール-5-イル)フェノキシ]ブトキシ}フェニル)-4,4-ジメチル-1-(プロパン-2-イル)-4,5-ジヒドロ-1H-ピラゾール-5-オン
  • 3-(4-methoxy-3-{4-[4-(1H-1,2,3,4-tetrazol-5-yl)phenoxy]butoxy}phenyl)-4,4-dimethyl-1-(propan-2-yl)-4,5-dihydro-1H-pyrazol-5-one
Other name (2)：
  • 4,5-Dihydro-3-[4-methoxy-3-[4-[4-(1H-tetrazole-5-yl)phenoxy]butoxy]phenyl]-4,4-dimethyl-1-isopropyl-1H-pyrazole-5-one
  • VFU-13524
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