Chem
J-GLOBAL ID：201407081898634418   Nikkaji number：J3.324.093G

2-[5-(1,3,5-Trimethyl-1H-pyrazole-4-ylmethyl)-1,3,4-oxadiazole-2-yl]-3-(4-piperidinyloxy)benzo[b]thiophene

2-[5-(1,3,5-トリメチル-1H-ピラゾール-4-イルメチル)-1,3,4-オキサジアゾール-2-イル]-3-(4-ピペリジニルオキシ)ベンゾ[b]チオフェン
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： C22H25N5O2S
Molecular formula furigana： C22-H25-N5-O2-S
Molecular weight： 423.540
InChI： InChI=1S/C22H25N5O2S/c1-13-17(14(2)27(3)26-13)12-19-24-25-22(29-19)21-20(28-15-8-10-23-11-9-15)16-6-4-5-7-18(16)30-21/h4-7,15,23H,8-12H2,1-3H3
InChI key： XZORQADPEUSNQJ-UHFFFAOYSA-N
SMILES： Cc1nn(C)c(C)c1Cc1nnc(o1)c1sc2ccccc2c1OC1CCNCC1
Systematic name  (3)：
  • 2-[5-(1,3,5-トリメチル-1H-ピラゾール-4-イルメチル)-1,3,4-オキサジアゾール-2-イル]-3-(4-ピペリジニルオキシ)ベンゾ[b]チオフェン
  • 4-[(2-{5-[(1,3,5-トリメチル-1H-ピラゾール-4-イル)メチル]-1,3,4-オキサジアゾール-2-イル}-1-ベンゾチオフェン-3-イル)オキシ]ピペリジン
  • 4-[(2-{5-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-1,3,4-oxadiazol-2-yl}-1-benzothiophen-3-yl)oxy]piperidine
Other name (1)：
  • 2-[5-(1,3,5-Trimethyl-1H-pyrazole-4-ylmethyl)-1,3,4-oxadiazole-2-yl]-3-(4-piperidinyloxy)benzo[b]thiophene
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