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(2E)-N-(5-{[2-(2,5-dimethoxyanilino)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-phenyl-2-propenamide
SpectraBase Compound ID JLfdmVPJN25
InChI InChI=1S/C21H20N4O4S2/c1-28-15-9-10-17(29-2)16(12-15)22-19(27)13-30-21-25-24-20(31-21)23-18(26)11-8-14-6-4-3-5-7-14/h3-12H,13H2,1-2H3,(H,22,27)(H,23,24,26)/b11-8+
InChIKey UBQCBOKYGQPQBP-DHZHZOJOSA-N
Mol Weight 456.54 g/mol
Molecular Formula C21H20N4O4S2
Exact Mass 456.092597 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DzeeI3exnm0
Name (2E)-N-(5-{[2-(2,5-dimethoxyanilino)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-phenyl-2-propenamide
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/C21H20N4O4S2/c1-28-15-9-10-17(29-2)16(12-15)22-19(27)13-30-21-25-24-20(31-21)23-18(26)11-8-14-6-4-3-5-7-14/h3-12H,13H2,1-2H3,(H,22,27)(H,23,24,26)/b11-8+
InChIKey UBQCBOKYGQPQBP-DHZHZOJOSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_19898
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: D14949; Labnumber: SPKOL-4225; SBI_ID: SBI-019902
Synonyms N-(5-{[2-(2,5-dimethoxyanilino)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-phenyl-2-propenamide
Temperature 306 °C