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2-{[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydro-2-pyrimidinyl]sulfanyl}-N-(5-methyl-3-isoxazolyl)butanamide
SpectraBase Compound ID AQ6AqVbPRUA
InChI InChI=1S/C19H21N5O3S/c1-4-14(18(26)21-16-9-12(3)27-23-16)28-19-22-17(25)10-15(20)24(19)13-7-5-6-11(2)8-13/h5-10,14H,4,20H2,1-3H3,(H,21,23,26)
InChIKey WLPRYRZXSWHYCR-UHFFFAOYSA-N
Mol Weight 399.47 g/mol
Molecular Formula C19H21N5O3S
Exact Mass 399.136511 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KpRihUIY7ki
Name 2-{[6-amino-1-(3-methylphenyl)-4-oxo-1,4-dihydro-2-pyrimidinyl]sulfanyl}-N-(5-methyl-3-isoxazolyl)butanamide
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/C19H21N5O3S/c1-4-14(18(26)21-16-9-12(3)27-23-16)28-19-22-17(25)10-15(20)24(19)13-7-5-6-11(2)8-13/h5-10,14H,4,20H2,1-3H3,(H,21,23,26)
InChIKey WLPRYRZXSWHYCR-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_8001
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: 9685921; UBI_ID: UBI-008004
Temperature 308 °C