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N-[3-(4-ethylpiperazin-1-yl)carbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]thiophene-2-carboxamide
SpectraBase Compound ID DgjRmyvwPWd
InChI InChI=1S/C20H25N3O2S2/c1-2-22-9-11-23(12-10-22)20(25)17-14-6-3-4-7-15(14)27-19(17)21-18(24)16-8-5-13-26-16/h5,8,13H,2-4,6-7,9-12H2,1H3,(H,21,24)
InChIKey NUENWGVGWHPQHZ-UHFFFAOYSA-N
Mol Weight 403.56 g/mol
Molecular Formula C20H25N3O2S2
Exact Mass 403.138819 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ATgQD9yZ5Kr
Name 2-thiophenecarboxamide, N-[3-[(4-ethyl-1-piperazinyl)carbonyl]-4,5,6,7-tetrahydrobenzo[b]thien-2-yl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 403.138819403 u
Formula C20H25N3O2S2
InChI InChI=1S/C20H25N3O2S2/c1-2-22-9-11-23(12-10-22)20(25)17-14-6-3-4-7-15(14)27-19(17)21-18(24)16-8-5-13-26-16/h5,8,13H,2-4,6-7,9-12H2,1H3,(H,21,24)
InChIKey NUENWGVGWHPQHZ-UHFFFAOYSA-N
Molecular Weight 403.559 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_12266
Solvent DMSO-d6
Source Vendor ID: NMR/10272030; Lab Info: DEC; Lab Number: DEC-S000205