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methyl 3-amino-2-({1-[(3-methoxyanilino)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-[(3-methoxyanilino)carbonyl]propyl}sulfanyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
SpectraBase Compound ID 6QiyW5sz1X0
InChI InChI=1S/C20H22N4O5S2/c1-5-13(16(25)22-11-7-6-8-12(9-11)28-3)30-20-23-17-14(18(26)24(20)21)10(2)15(31-17)19(27)29-4/h6-9,13H,5,21H2,1-4H3,(H,22,25)
InChIKey DRUREMQEXRRAGU-UHFFFAOYSA-N
Mol Weight 462.54 g/mol
Molecular Formula C20H22N4O5S2
Exact Mass 462.103162 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 93h3wRlIlS2
Name methyl 3-amino-2-({1-[(3-methoxyanilino)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 462.103162167 u
Formula C20H22N4O5S2
InChI InChI=1S/C20H22N4O5S2/c1-5-13(16(25)22-11-7-6-8-12(9-11)28-3)30-20-23-17-14(18(26)24(20)21)10(2)15(31-17)19(27)29-4/h6-9,13H,5,21H2,1-4H3,(H,22,25)
InChIKey DRUREMQEXRRAGU-UHFFFAOYSA-N
Molecular Weight 462.539 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_7314
Solvent DMSO-d6
Source Vendor ID: NMR/13218057