4-Fluoro-N-{[(1S,4S,6S)-6-isopropyl-3-methyl-4-{2-oxo-2-[(2-pyridinylmethyl)amino]ethyl}-2-cyclohexen-1-yl]methyl}benzamide

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Systematic / IUPAC Name: 4-Fluoro-N-[[(1S,4S,6S)-3-methyl-4-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]-6-propan-2-ylcyclohex-2-en-1-yl]methyl]benzamide

ID: Reference10425

Other Names: Benzamide, 4-fluoro-N-[[(1S,4S,6S)-3-methyl-6-(1-methylethyl)-4-[2-oxo-2-[(2-pyridinylmethyl)amino]ethyl]-2-cyclohexen-1-yl]methyl]-;
NAT28-405658

Formula: C26H32FN3O2

Spectral Data

4-Fluoro-N-{[(1S,4S,6S)-6-isopropyl-3-methyl-4-{2-oxo-2-[(2-pyridinylmethyl)amino]ethyl}-2-cyclohexen-1-yl]methyl}benzamide 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 1035
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 4/30/2021 8:23:07 AM
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Identificators

InChI InChI=1S/C26H32FN3O2/c1-17(2)24-13-20(14-25(31)29-16-23-6-4-5-11-28-23)18(3)12-21(24)15-30-26(32)19-7-9-22(27)10-8-19/h4-12,17,20-21,24H,13-16H2,1-3H3,(H,29,31)(H,30,32)/t20-,21-,24-/m0/s1
InChI Key AASIMTDAQSJBQC-HFMPRLQTSA-N
Canonical SMILES CC1=CC(C(CC1CC(=O)NCC2=CC=CC=N2)C(C)C)CNC(=O)C3=CC=C(C=C3)F
CAS
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Other Names Benzamide, 4-fluoro-N-[[(1S,4S,6S)-3-methyl-6-(1-methylethyl)-4-[2-oxo-2-[(2-pyridinylmethyl)amino]ethyl]-2-cyclohexen-1-yl]methyl]-;
NAT28-405658

In Other Databases

ChemSpider 22937153
PubChem 38028361