1-Methyl-4-[5-(5-{(2S)-1-[4-(trifluoromethyl)benzyl]-2-pyrrolidinyl}-1,2,4-oxadiazol-3-yl)-2-pyridinyl]piperazine

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Systematic / IUPAC Name: 3-[6-(4-Methylpiperazin-1-yl)pyridin-3-yl]-5-[(2S)-1-[[4-(trifluoromethyl)phenyl]methyl]pyrrolidin-2-yl]-1,2,4-oxadiazole

ID: Reference10085

Other Names: Piperazine, 1-methyl-4-[5-[5-[(2S)-1-[[4-(trifluoromethyl)phenyl]methyl]-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-2-pyridinyl]-;
NAT18-432321

Formula: C24H27F3N6O

Spectral Data

1-Methyl-4-[5-(5-{(2S)-1-[4-(trifluoromethyl)benzyl]-2-pyrrolidinyl}-1,2,4-oxadiazol-3-yl)-2-pyridinyl]piperazine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 1468
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 11/19/2020 10:11:40 AM
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Identificators

InChI InChI=1S/C24H27F3N6O/c1-31-11-13-32(14-12-31)21-9-6-18(15-28-21)22-29-23(34-30-22)20-3-2-10-33(20)16-17-4-7-19(8-5-17)24(25,26)27/h4-9,15,20H,2-3,10-14,16H2,1H3/t20-/m0/s1
InChI Key PUOOBSCPEIABAH-FQEVSTJZSA-N
Canonical SMILES CN1CCN(CC1)C2=NC=C(C=C2)C3=NOC(=N3)C4CCCN4CC5=CC=C(C=C5)C(F)(F)F
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Other Names Piperazine, 1-methyl-4-[5-[5-[(2S)-1-[[4-(trifluoromethyl)phenyl]methyl]-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-2-pyridinyl]-;
NAT18-432321

In Other Databases

PubChem 51136861
ChemSpider 29857921