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2-{[4-allyl-5-(4-bromophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1-naphthyl)acetamide
SpectraBase Compound ID 2s3Qis4I8Am
InChI InChI=1S/C23H19BrN4OS/c1-2-14-28-22(17-10-12-18(24)13-11-17)26-27-23(28)30-15-21(29)25-20-9-5-7-16-6-3-4-8-19(16)20/h2-13H,1,14-15H2,(H,25,29)
InChIKey VPEXRKWPPDGDRU-UHFFFAOYSA-N
Mol Weight 479.4 g/mol
Molecular Formula C23H19BrN4OS
Exact Mass 478.046295 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FQAWvAFcy6v
Name 2-{[4-allyl-5-(4-bromophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1-naphthyl)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/C23H19BrN4OS/c1-2-14-28-22(17-10-12-18(24)13-11-17)26-27-23(28)30-15-21(29)25-20-9-5-7-16-6-3-4-8-19(16)20/h2-13H,1,14-15H2,(H,25,29)
InChIKey VPEXRKWPPDGDRU-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_17362
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: UZI/9052166; UBI_ID: UBI-017365
Temperature 313 °C