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N-(2-isopropylphenyl)-2-{[4-(4-methoxyphenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

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N-(2-isopropylphenyl)-2-{[4-(4-methoxyphenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID Jb2sdQW8CXJ
InChI InChI=1S/C27H28N4O2S/c1-18(2)23-7-5-6-8-24(23)28-25(32)17-34-27-30-29-26(20-11-9-19(3)10-12-20)31(27)21-13-15-22(33-4)16-14-21/h5-16,18H,17H2,1-4H3,(H,28,32)
InChIKey MWQBJIQFTXMVLH-UHFFFAOYSA-N
Mol Weight 472.61 g/mol
Molecular Formula C27H28N4O2S
Exact Mass 472.193297 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 52KMtWn4BID
Name N-(2-isopropylphenyl)-2-{[4-(4-methoxyphenyl)-5-(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/C27H28N4O2S/c1-18(2)23-7-5-6-8-24(23)28-25(32)17-34-27-30-29-26(20-11-9-19(3)10-12-20)31(27)21-13-15-22(33-4)16-14-21/h5-16,18H,17H2,1-4H3,(H,28,32)
InChIKey MWQBJIQFTXMVLH-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14624
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: D98794; Labnumber: GRES-26410; SBI_ID: SBI-014627
Temperature 318 °C