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2-{[3-(3-isopropoxypropyl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
SpectraBase Compound ID 6VOgrL81lil
InChI InChI=1S/C18H21N3O3S2/c1-11(2)24-9-5-8-21-17(23)16-15(20-18(21)25-10-14(19)22)12-6-3-4-7-13(12)26-16/h3-4,6-7,11H,5,8-10H2,1-2H3,(H2,19,22)
InChIKey YLGSLSHDZNMXOA-UHFFFAOYSA-N
Mol Weight 391.5 g/mol
Molecular Formula C18H21N3O3S2
Exact Mass 391.102434 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HvOccABtNIc
Name 2-{[3-(3-isopropoxypropyl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 391.102433893 u
Formula C18H21N3O3S2
InChI InChI=1S/C18H21N3O3S2/c1-11(2)24-9-5-8-21-17(23)16-15(20-18(21)25-10-14(19)22)12-6-3-4-7-13(12)26-16/h3-4,6-7,11H,5,8-10H2,1-2H3,(H2,19,22)
InChIKey YLGSLSHDZNMXOA-UHFFFAOYSA-N
Molecular Weight 391.504 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_6229
Solvent DMSO-d6
Source Vendor ID: NMR/12328316