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3-isopentyl-2-{[1-(4-morpholinylcarbonyl)propyl]sulfanyl}[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
SpectraBase Compound ID BC9yYP9GiuC
InChI InChI=1S/C23H29N3O3S2/c1-4-17(21(27)25-11-13-29-14-12-25)31-23-24-19-16-7-5-6-8-18(16)30-20(19)22(28)26(23)10-9-15(2)3/h5-8,15,17H,4,9-14H2,1-3H3
InChIKey HEOWRSRHGZLUFL-UHFFFAOYSA-N
Mol Weight 459.62 g/mol
Molecular Formula C23H29N3O3S2
Exact Mass 459.165034 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1y8OypJ3wdk
Name 3-isopentyl-2-{[1-(4-morpholinylcarbonyl)propyl]sulfanyl}[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 459.165034151 u
Formula C23H29N3O3S2
InChI InChI=1S/C23H29N3O3S2/c1-4-17(21(27)25-11-13-29-14-12-25)31-23-24-19-16-7-5-6-8-18(16)30-20(19)22(28)26(23)10-9-15(2)3/h5-8,15,17H,4,9-14H2,1-3H3
InChIKey HEOWRSRHGZLUFL-UHFFFAOYSA-N
Molecular Weight 459.623 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_6653
Solvent DMSO-d6
Source Vendor ID: NMR/12328938