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2-{[3-(2-hydroxyethyl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(4-isopropylphenyl)acetamide
SpectraBase Compound ID 3H1CUKORmGc
InChI InChI=1S/C23H23N3O3S2/c1-14(2)15-7-9-16(10-8-15)24-19(28)13-30-23-25-20-17-5-3-4-6-18(17)31-21(20)22(29)26(23)11-12-27/h3-10,14,27H,11-13H2,1-2H3,(H,24,28)
InChIKey QSHOKDVSYWAYPK-UHFFFAOYSA-N
Mol Weight 453.58 g/mol
Molecular Formula C23H23N3O3S2
Exact Mass 453.118084 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3YAmBqK3AsU
Name 2-{[3-(2-hydroxyethyl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(4-isopropylphenyl)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 453.118083958 u
Formula C23H23N3O3S2
InChI InChI=1S/C23H23N3O3S2/c1-14(2)15-7-9-16(10-8-15)24-19(28)13-30-23-25-20-17-5-3-4-6-18(17)31-21(20)22(29)26(23)11-12-27/h3-10,14,27H,11-13H2,1-2H3,(H,24,28)
InChIKey QSHOKDVSYWAYPK-UHFFFAOYSA-N
Molecular Weight 453.575 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_7794
Solvent DMSO-d6
Source Vendor ID: NMR/13218539