1-(4-Methyl-1-piperazinyl)-2-[(3R,4S)-3-({5-[4-(2-methyl-2-propanyl)phenyl]-1,2-oxazol-3-yl}methyl)-4-piperidinyl]ethanone

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Systematic / IUPAC Name: 2-[(3R,4S)-3-[[5-(4-tert-Butylphenyl)-1,2-oxazol-3-yl]methyl]piperidin-4-yl]-1-(4-methylpiperazin-1-yl)ethanone

ID: Reference9470

Other Names: Ethanone, 2-[(3R,4S)-3-[[5-[4-(1,1-dimethylethyl)phenyl]-3-isoxazolyl]methyl]-4-piperidinyl]-1-(4-methyl-1-piperazinyl)-;
NAT14-350409

Formula: C26H38N4O2

Spectral Data

1-(4-Methyl-1-piperazinyl)-2-[(3R,4S)-3-({5-[4-(2-methyl-2-propanyl)phenyl]-1,2-oxazol-3-yl}methyl)-4-piperidinyl]ethanone 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 2887
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6, MS7
Ionization Methods NSI
Analyzers FT
Last Modification 3/11/2020 10:22:19 AM
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Identificators

InChI InChI=1S/C26H38N4O2/c1-26(2,3)22-7-5-19(6-8-22)24-17-23(28-32-24)15-21-18-27-10-9-20(21)16-25(31)30-13-11-29(4)12-14-30/h5-8,17,20-21,27H,9-16,18H2,1-4H3/t20-,21-/m0/s1
InChI Key SMXKTZQYJBEJJI-SFTDATJTSA-N
Canonical SMILES CC(C)(C)C1=CC=C(C=C1)C2=CC(=NO2)CC3CNCCC3CC(=O)N4CCN(CC4)C
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Other Names Ethanone, 2-[(3R,4S)-3-[[5-[4-(1,1-dimethylethyl)phenyl]-3-isoxazolyl]methyl]-4-piperidinyl]-1-(4-methyl-1-piperazinyl)-;
NAT14-350409

In Other Databases

PubChem 26743300
ChemSpider 21385048