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2-{[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methylphenyl)acetamide
SpectraBase Compound ID 4kS3jR5rGkC
InChI InChI=1S/C28H30N4OS/c1-19-9-15-24(16-10-19)32-26(21-11-13-22(14-12-21)28(3,4)5)30-31-27(32)34-18-25(33)29-23-8-6-7-20(2)17-23/h6-17H,18H2,1-5H3,(H,29,33)
InChIKey ZIUFXDOQFWGSFC-UHFFFAOYSA-N
Mol Weight 470.64 g/mol
Molecular Formula C28H30N4OS
Exact Mass 470.214033 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7bvrkzNyL2G
Name 2-{[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methylphenyl)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/C28H30N4OS/c1-19-9-15-24(16-10-19)32-26(21-11-13-22(14-12-21)28(3,4)5)30-31-27(32)34-18-25(33)29-23-8-6-7-20(2)17-23/h6-17H,18H2,1-5H3,(H,29,33)
InChIKey ZIUFXDOQFWGSFC-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4329
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: D98827; Labnumber: GRES-26891; SBI_ID: SBI-004331
Temperature 306 °C