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4-{3-[(imino{(2E)-2-[1-(2-thienyl)ethylidene]hydrazino}methyl)sulfanyl]-2,5-dioxo-1-pyrrolidinyl}benzoic acid
SpectraBase Compound ID 9iHGuVQgpis
InChI InChI=1S/C18H16N4O4S2/c1-10(13-3-2-8-27-13)20-21-18(19)28-14-9-15(23)22(16(14)24)12-6-4-11(5-7-12)17(25)26/h2-8,14H,9H2,1H3,(H2,19,21)(H,25,26)/b20-10+
InChIKey ARXRXCDIRUPXFH-KEBDBYFISA-N
Mol Weight 416.47 g/mol
Molecular Formula C18H16N4O4S2
Exact Mass 416.061297 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CySt7G0dQDK
Name 4-{3-[(imino{(2E)-2-[1-(2-thienyl)ethylidene]hydrazino}methyl)sulfanyl]-2,5-dioxo-1-pyrrolidinyl}benzoic acid
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/C18H16N4O4S2/c1-10(13-3-2-8-27-13)20-21-18(19)28-14-9-15(23)22(16(14)24)12-6-4-11(5-7-12)17(25)26/h2-8,14H,9H2,1H3,(H2,19,21)(H,25,26)/b20-10+
InChIKey ARXRXCDIRUPXFH-KEBDBYFISA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_4448
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: NMR/8325336; Labnumber: UST-AL00020; IOH_ID: IOH-004449
Synonyms 4-{3-[(imino{2-[1-(2-thienyl)ethylidene]hydrazino}methyl)sulfanyl]-2,5-dioxo-1-pyrrolidinyl}benzoic acid
Temperature 297 °C