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[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one, 5,6,7,9-tetrahydro-9-(4-methylphenyl)-2-[[[4-(5-phenyl-2-oxazolyl)phenyl]methyl]thio]-

View entire compound with spectra: 1 NMR

[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one, 5,6,7,9-tetrahydro-9-(4-methylphenyl)-2-[[[4-(5-phenyl-2-oxazolyl)phenyl]methyl]thio]-
SpectraBase Compound ID 7QmtGY9ClTC
InChI InChI=1S/C32H27N5O2S/c1-20-10-14-23(15-11-20)29-28-25(8-5-9-26(28)38)34-31-35-32(36-37(29)31)40-19-21-12-16-24(17-13-21)30-33-18-27(39-30)22-6-3-2-4-7-22/h2-4,6-7,10-18,29H,5,8-9,19H2,1H3,(H,34,35,36)
InChIKey LEPQQSJQAGMDNJ-UHFFFAOYSA-N
Mol Weight 545.7 g/mol
Molecular Formula C32H27N5O2S
Exact Mass 545.188546 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2TLPjBdlBm
Name [1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one, 5,6,7,9-tetrahydro-9-(4-methylphenyl)-2-[[[4-(5-phenyl-2-oxazolyl)phenyl]methyl]thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 545.188546301 u
Formula C32H27N5O2S
InChI InChI=1S/C32H27N5O2S/c1-20-10-14-23(15-11-20)29-28-25(8-5-9-26(28)38)34-31-35-32(36-37(29)31)40-19-21-12-16-24(17-13-21)30-33-18-27(39-30)22-6-3-2-4-7-22/h2-4,6-7,10-18,29H,5,8-9,19H2,1H3,(H,34,35,36)
InChIKey LEPQQSJQAGMDNJ-UHFFFAOYSA-N
Molecular Weight 545.661 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_835
Solvent DMSO-d6
Source Vendor ID: NMR/13239291