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N-cyclopentyl-2-[(3-isopentyl-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide
SpectraBase Compound ID LVUwt4yNDpf
InChI InChI=1S/C22H27N3O2S2/c1-14(2)11-12-25-21(27)20-19(16-9-5-6-10-17(16)29-20)24-22(25)28-13-18(26)23-15-7-3-4-8-15/h5-6,9-10,14-15H,3-4,7-8,11-13H2,1-2H3,(H,23,26)
InChIKey PUYKEMAINSLIFO-UHFFFAOYSA-N
Mol Weight 429.6 g/mol
Molecular Formula C22H27N3O2S2
Exact Mass 429.154469 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5a2pljEYpjL
Name N-cyclopentyl-2-[(3-isopentyl-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 429.154469467 u
Formula C22H27N3O2S2
InChI InChI=1S/C22H27N3O2S2/c1-14(2)11-12-25-21(27)20-19(16-9-5-6-10-17(16)29-20)24-22(25)28-13-18(26)23-15-7-3-4-8-15/h5-6,9-10,14-15H,3-4,7-8,11-13H2,1-2H3,(H,23,26)
InChIKey PUYKEMAINSLIFO-UHFFFAOYSA-N
Molecular Weight 429.597 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_6636
Solvent DMSO-d6
Source Vendor ID: NMR/12328912