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2-thiophenecarboxylic acid, 3-[[[4-(2,5-dimethylphenyl)-1-piperazinyl]carbonothioyl]amino]-, methyl ester
SpectraBase Compound ID 5HmuGUzaS57
InChI InChI=1S/C19H23N3O2S2/c1-13-4-5-14(2)16(12-13)21-7-9-22(10-8-21)19(25)20-15-6-11-26-17(15)18(23)24-3/h4-6,11-12H,7-10H2,1-3H3,(H,20,25)
InChIKey BRTJTTYVQVSSDC-UHFFFAOYSA-N
Mol Weight 389.53 g/mol
Molecular Formula C19H23N3O2S2
Exact Mass 389.123169 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2p31h1WIKKv
Name 2-thiophenecarboxylic acid, 3-[[[4-(2,5-dimethylphenyl)-1-piperazinyl]carbonothioyl]amino]-, 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 389.123169339 u
Formula C19H23N3O2S2
InChI InChI=1S/C19H23N3O2S2/c1-13-4-5-14(2)16(12-13)21-7-9-22(10-8-21)19(25)20-15-6-11-26-17(15)18(23)24-3/h4-6,11-12H,7-10H2,1-3H3,(H,20,25)
InChIKey BRTJTTYVQVSSDC-UHFFFAOYSA-N
Molecular Weight 389.532 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_1043
Solvent DMSO-d6
Source Vendor ID: NMR/13239628