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N-[4-(dimethylamino)phenyl]-2-{[5-(3-methylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID 1ozi94Van7o
InChI InChI=1S/C26H27N5OS/c1-18-8-12-23(13-9-18)31-25(20-7-5-6-19(2)16-20)28-29-26(31)33-17-24(32)27-21-10-14-22(15-11-21)30(3)4/h5-16H,17H2,1-4H3,(H,27,32)
InChIKey CDQKOXRATMYAHO-UHFFFAOYSA-N
Mol Weight 457.6 g/mol
Molecular Formula C26H27N5OS
Exact Mass 457.193632 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CgUrsAUMkES
Name N-[4-(dimethylamino)phenyl]-2-{[5-(3-methylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-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/C26H27N5OS/c1-18-8-12-23(13-9-18)31-25(20-7-5-6-19(2)16-20)28-29-26(31)33-17-24(32)27-21-10-14-22(15-11-21)30(3)4/h5-16H,17H2,1-4H3,(H,27,32)
InChIKey CDQKOXRATMYAHO-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4849
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: E08242; Labnumber: GRES-36827; SBI_ID: SBI-004851
Temperature 315 °C