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thieno[2,3-d]pyrimidine-6-carboxylic acid, 3-amino-3,4-dihydro-5-methyl-2-[[2-[(3-methylphenyl)amino]-2-oxoethyl]thio]-4-oxo-, methyl ester

View entire compound with spectra: 1 NMR

thieno[2,3-d]pyrimidine-6-carboxylic acid, 3-amino-3,4-dihydro-5-methyl-2-[[2-[(3-methylphenyl)amino]-2-oxoethyl]thio]-4-oxo-, methyl ester
SpectraBase Compound ID 4qSvy1021y9
InChI InChI=1S/C18H18N4O4S2/c1-9-5-4-6-11(7-9)20-12(23)8-27-18-21-15-13(16(24)22(18)19)10(2)14(28-15)17(25)26-3/h4-7H,8,19H2,1-3H3,(H,20,23)
InChIKey AUROAVHZHWECIK-UHFFFAOYSA-N
Mol Weight 418.49 g/mol
Molecular Formula C18H18N4O4S2
Exact Mass 418.076947 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID H93CG1M10CA
Name thieno[2,3-d]pyrimidine-6-carboxylic acid, 3-amino-3,4-dihydro-5-methyl-2-[[2-[(3-methylphenyl)amino]-2-oxoethyl]thio]-4-oxo-, methyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 418.076947420 u
Formula C18H18N4O4S2
InChI InChI=1S/C18H18N4O4S2/c1-9-5-4-6-11(7-9)20-12(23)8-27-18-21-15-13(16(24)22(18)19)10(2)14(28-15)17(25)26-3/h4-7H,8,19H2,1-3H3,(H,20,23)
InChIKey AUROAVHZHWECIK-UHFFFAOYSA-N
Molecular Weight 418.486 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_1144
Solvent DMSO-d6
Source Vendor ID: NMR/13239742