N-{[(1S,4S,6S)-6-Isopropyl-4-{2-[(4-methoxybenzyl)amino]-2-oxoethyl}-3-methyl-2-cyclohexen-1-yl]methyl}-5-pyrimidinecarboxamide

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Systematic / IUPAC Name: N-[[(1S,4S,6S)-4-[2-[(4-Methoxyphenyl)methylamino]-2-oxoethyl]-3-methyl-6-propan-2-ylcyclohex-2-en-1-yl]methyl]pyrimidine-5-carboxamide

ID: Reference10435

Other Names: NAT28-404371

Formula: C26H34N4O3

Spectral Data

N-{[(1S,4S,6S)-6-Isopropyl-4-{2-[(4-methoxybenzyl)amino]-2-oxoethyl}-3-methyl-2-cyclohexen-1-yl]methyl}-5-pyrimidinecarboxamide 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 2
No. of Spectra 2474
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 5/6/2021 2:30:27 PM
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Identificators

InChI InChI=1S/C26H34N4O3/c1-17(2)24-10-20(11-25(31)29-12-19-5-7-23(33-4)8-6-19)18(3)9-21(24)15-30-26(32)22-13-27-16-28-14-22/h5-9,13-14,16-17,20-21,24H,10-12,15H2,1-4H3,(H,29,31)(H,30,32)/t20-,21-,24-/m0/s1
InChI Key MMZUZUKKQWPADC-HFMPRLQTSA-N
Canonical SMILES CC1=CC(C(CC1CC(=O)NCC2=CC=C(C=C2)OC)C(C)C)CNC(=O)C3=CN=CN=C3
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Other Names NAT28-404371

In Other Databases

PubChem 38027816
ChemSpider 22937079