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N-(2-{[2-(2-nitroanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(1-phenyl-1H-tetraazol-5-yl)sulfanyl]acetamide
SpectraBase Compound ID 5Ro35tdoReX
InChI InChI=1S/C24H18N8O4S3/c33-21(13-37-23-28-29-30-31(23)16-6-2-1-3-7-16)25-15-10-11-18-20(12-15)39-24(27-18)38-14-22(34)26-17-8-4-5-9-19(17)32(35)36/h1-12H,13-14H2,(H,25,33)(H,26,34)
InChIKey RICPVTUMLGZFJR-UHFFFAOYSA-N
Mol Weight 578.64 g/mol
Molecular Formula C24H18N8O4S3
Exact Mass 578.061315 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ESKwLNTRXlu
Name N-(2-{[2-(2-nitroanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(1-phenyl-1H-tetraazol-5-yl)sulfanyl]acetamide
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/C24H18N8O4S3/c33-21(13-37-23-28-29-30-31(23)16-6-2-1-3-7-16)25-15-10-11-18-20(12-15)39-24(27-18)38-14-22(34)26-17-8-4-5-9-19(17)32(35)36/h1-12H,13-14H2,(H,25,33)(H,26,34)
InChIKey RICPVTUMLGZFJR-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7000_3912
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/8325832; Labnumber: LP-0607007; IOH_ID: IOH-003913
Temperature 303 °C