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methyl 3-amino-5-methyl-2-({2-[(3-methyl-1H-pyrazol-5-yl)amino]-2-oxoethyl}sulfanyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
SpectraBase Compound ID JN8UgLAXiH8
InChI InChI=1S/C15H16N6O4S2/c1-6-4-8(20-19-6)17-9(22)5-26-15-18-12-10(13(23)21(15)16)7(2)11(27-12)14(24)25-3/h4H,5,16H2,1-3H3,(H2,17,19,20,22)
InChIKey ZOULZADWDXMCJU-UHFFFAOYSA-N
Mol Weight 408.45 g/mol
Molecular Formula C15H16N6O4S2
Exact Mass 408.067445 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EoerQXO42DH
Name methyl 3-amino-5-methyl-2-({2-[(3-methyl-1H-pyrazol-5-yl)amino]-2-oxoethyl}sulfanyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 408.067445363 u
Formula C15H16N6O4S2
InChI InChI=1S/C15H16N6O4S2/c1-6-4-8(20-19-6)17-9(22)5-26-15-18-12-10(13(23)21(15)16)7(2)11(27-12)14(24)25-3/h4H,5,16H2,1-3H3,(H2,17,19,20,22)
InChIKey ZOULZADWDXMCJU-UHFFFAOYSA-N
Molecular Weight 408.451 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_8176
Solvent DMSO-d6
Source Vendor ID: NMR/13219203