Chem
J-GLOBAL ID：201607013030537700   Nikkaji number：J3.498.906K

VFU-13525

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-シクロヘプチル-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： C30H38N6O4
Molecular formula furigana： C30-H38-N6-O4
Molecular weight： 546.672
InChI： InChI=1S/C30H38N6O4/c1-30(2)27(33-36(29(30)37)23-10-6-4-5-7-11-23)22-14-17-25(38-3)26(20-22)40-19-9-8-18-39-24-15-12-21(13-16-24)28-31-34-35-32-28/h12-17,20,23H,4-11,18-19H2,1-3H3,(H,31,32,34,35)
InChI key： JPXAIORZGBCHIB-UHFFFAOYSA-N
SMILES： COc1ccc(cc1OCCCCOc1ccc(cc1)c1nnn[nH]1)C1=NN(C2CCCCCC2)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-シクロヘプチル-1H-ピラゾール-5-オン
  • 1-シクロヘプチル-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-4,5-ジヒドロ-1H-ピラゾール-5-オン
  • 1-cycloheptyl-3-(4-methoxy-3-{4-[4-(1H-1,2,3,4-tetrazol-5-yl)phenoxy]butoxy}phenyl)-4,4-dimethyl-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-cycloheptyl-1H-pyrazole-5-one
  • VFU-13525
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