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N-(4-fluorophenyl)-2-[(2E)-2-(4-methoxy-3-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}benzylidene)hydrazino]-2-oxoacetamide

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N-(4-fluorophenyl)-2-[(2E)-2-(4-methoxy-3-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}benzylidene)hydrazino]-2-oxoacetamide
SpectraBase Compound ID FGbmLPdLoAI
InChI InChI=1S/C20H18FN5O3S2/c1-12-24-26-20(31-12)30-11-14-9-13(3-8-17(14)29-2)10-22-25-19(28)18(27)23-16-6-4-15(21)5-7-16/h3-10H,11H2,1-2H3,(H,23,27)(H,25,28)/b22-10+
InChIKey AYYSIRWCKUDIBP-LSHDLFTRSA-N
Mol Weight 459.51 g/mol
Molecular Formula C20H18FN5O3S2
Exact Mass 459.08351 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID C0jBvxqAxmP
Name N-(4-fluorophenyl)-2-[(2E)-2-(4-methoxy-3-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}benzylidene)hydrazino]-2-oxoacetamide
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/C20H18FN5O3S2/c1-12-24-26-20(31-12)30-11-14-9-13(3-8-17(14)29-2)10-22-25-19(28)18(27)23-16-6-4-15(21)5-7-16/h3-10H,11H2,1-2H3,(H,23,27)(H,25,28)/b22-10+
InChIKey AYYSIRWCKUDIBP-LSHDLFTRSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_20995
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: D51916; Labnumber: NIG-P1070; SBI_ID: SBI-020999
Synonyms N-(4-fluorophenyl)-2-[2-(4-methoxy-3-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}benzylidene)hydrazino]-2-oxoacetamide
Temperature 318 °C