1-(4-Methylphenyl)-3-{(3S,5S)-1-methyl-5-[3-(2-pyridinyl)-1,2,4-oxadiazol-5-yl]-3-pyrrolidinyl}urea

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Systematic / IUPAC Name: 1-(4-Methylphenyl)-3-[(3S,5S)-1-methyl-5-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]urea

ID: Reference9957

Other Names: Urea, N-(4-methylphenyl)-N'-[(3S,5S)-1-methyl-5-[3-(2-pyridinyl)-1,2,4-oxadiazol-5-yl]-3-pyrrolidinyl]-;
NAT18-355292

Formula: C20H22N6O2

Spectral Data

1-(4-Methylphenyl)-3-{(3S,5S)-1-methyl-5-[3-(2-pyridinyl)-1,2,4-oxadiazol-5-yl]-3-pyrrolidinyl}urea 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 1555
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 9/24/2020 6:28:57 AM
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Identificators

InChI InChI=1S/C20H22N6O2/c1-13-6-8-14(9-7-13)22-20(27)23-15-11-17(26(2)12-15)19-24-18(25-28-19)16-5-3-4-10-21-16/h3-10,15,17H,11-12H2,1-2H3,(H2,22,23,27)/t15-,17-/m0/s1
InChI Key SQMJBZPNAQUNGC-RDJZCZTQSA-N
Canonical SMILES CC1=CC=C(C=C1)NC(=O)NC2CC(N(C2)C)C3=NC(=NO3)C4=CC=CC=N4
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Other Names Urea, N-(4-methylphenyl)-N'-[(3S,5S)-1-methyl-5-[3-(2-pyridinyl)-1,2,4-oxadiazol-5-yl]-3-pyrrolidinyl]-;
NAT18-355292

In Other Databases

ChemSpider 22936884
PubChem 38026473