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methyl 3-amino-2-({1-[(butylamino)carbonyl]propyl}sulfanyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate

View entire compound with spectra: 1 NMR

methyl 3-amino-2-({1-[(butylamino)carbonyl]propyl}sulfanyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
SpectraBase Compound ID FcTCGMd5H0P
InChI InChI=1S/C17H24N4O4S2/c1-5-7-8-19-13(22)10(6-2)26-17-20-14-11(15(23)21(17)18)9(3)12(27-14)16(24)25-4/h10H,5-8,18H2,1-4H3,(H,19,22)
InChIKey NMMPBCFMYAEMDO-UHFFFAOYSA-N
Mol Weight 412.52 g/mol
Molecular Formula C17H24N4O4S2
Exact Mass 412.123898 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HgE5b04EXvU
Name methyl 3-amino-2-({1-[(butylamino)carbonyl]propyl}sulfanyl)-5-methyl-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 412.123897613 u
Formula C17H24N4O4S2
InChI InChI=1S/C17H24N4O4S2/c1-5-7-8-19-13(22)10(6-2)26-17-20-14-11(15(23)21(17)18)9(3)12(27-14)16(24)25-4/h10H,5-8,18H2,1-4H3,(H,19,22)
InChIKey NMMPBCFMYAEMDO-UHFFFAOYSA-N
Molecular Weight 412.523 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_8182
Solvent DMSO-d6
Source Vendor ID: NMR/13219209