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methyl 2-({oxo[(2E)-2-(3-pyridinylmethylene)hydrazino]acetyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
SpectraBase Compound ID JBJ16jUKwbz
InChI InChI=1S/C17H16N4O4S/c1-25-17(24)13-11-5-2-6-12(11)26-16(13)20-14(22)15(23)21-19-9-10-4-3-7-18-8-10/h3-4,7-9H,2,5-6H2,1H3,(H,20,22)(H,21,23)/b19-9+
InChIKey SZOZVYDVDOYIND-DJKKODMXSA-N
Mol Weight 372.4 g/mol
Molecular Formula C17H16N4O4S
Exact Mass 372.089226 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DP8LNgdPRHk
Name methyl 2-({oxo[(2E)-2-(3-pyridinylmethylene)hydrazino]acetyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C17H16N4O4S/c1-25-17(24)13-11-5-2-6-12(11)26-16(13)20-14(22)15(23)21-19-9-10-4-3-7-18-8-10/h3-4,7-9H,2,5-6H2,1H3,(H,20,22)(H,21,23)/b19-9+
InChIKey SZOZVYDVDOYIND-DJKKODMXSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_21043
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D51991; Labnumber: NIG-P3463; SBI_ID: SBI-021047
Synonyms methyl 2-({oxo[2-(3-pyridinylmethylene)hydrazino]acetyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Temperature 318 °C