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3-amino-N-(2,4-dimethylphenyl)-2-({1-[(3-methoxyanilino)carbonyl]propyl}sulfanyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-
SpectraBase Compound ID CjzLSoahTR5
InChI InChI=1S/C27H29N5O4S2/c1-6-20(23(33)29-17-8-7-9-18(13-17)36-5)37-27-31-25-21(26(35)32(27)28)16(4)22(38-25)24(34)30-19-11-10-14(2)12-15(19)3/h7-13,20H,6,28H2,1-5H3,(H,29,33)(H,30,34)
InChIKey ZIDJZVSQMHAMGT-UHFFFAOYSA-N
Mol Weight 551.68 g/mol
Molecular Formula C27H29N5O4S2
Exact Mass 551.166097 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HrM9SCQvoOE
Name 3-amino-N-(2,4-dimethylphenyl)-2-({1-[(3-methoxyanilino)carbonyl]propyl}sulfanyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 551.166096778 u
Formula C27H29N5O4S2
InChI InChI=1S/C27H29N5O4S2/c1-6-20(23(33)29-17-8-7-9-18(13-17)36-5)37-27-31-25-21(26(35)32(27)28)16(4)22(38-25)24(34)30-19-11-10-14(2)12-15(19)3/h7-13,20H,6,28H2,1-5H3,(H,29,33)(H,30,34)
InChIKey ZIDJZVSQMHAMGT-UHFFFAOYSA-N
Molecular Weight 551.680 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_6655
Solvent DMSO-d6
Source Vendor ID: NMR/12328941