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2-({3-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propyl]-4-oxo-3,4-dihydro-2-quinazolinyl}sulfanyl)-N-propylacetamide
SpectraBase Compound ID Js8nmzV9RxB
InChI InChI=1S/C21H27N5O2S/c1-4-10-22-19(27)14-29-21-23-18-9-6-5-8-17(18)20(28)25(21)11-7-12-26-16(3)13-15(2)24-26/h5-6,8-9,13H,4,7,10-12,14H2,1-3H3,(H,22,27)
InChIKey PUMBZFGQIQOSBO-UHFFFAOYSA-N
Mol Weight 413.54 g/mol
Molecular Formula C21H27N5O2S
Exact Mass 413.188546 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5EtsKFPrSm0
Name 2-({3-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propyl]-4-oxo-3,4-dihydro-2-quinazolinyl}sulfanyl)-N-propylacetamide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C21H27N5O2S/c1-4-10-22-19(27)14-29-21-23-18-9-6-5-8-17(18)20(28)25(21)11-7-12-26-16(3)13-15(2)24-26/h5-6,8-9,13H,4,7,10-12,14H2,1-3H3,(H,22,27)
InChIKey PUMBZFGQIQOSBO-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_31035
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 1728280; SBI_ID: SBI-031039
Temperature 308 °C