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

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N-[4-(dimethylamino)phenyl]-2-{[4-ethyl-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID 4nofULR50dj
InChI InChI=1S/C21H25N5O2S/c1-5-26-20(17-8-6-7-9-18(17)28-4)23-24-21(26)29-14-19(27)22-15-10-12-16(13-11-15)25(2)3/h6-13H,5,14H2,1-4H3,(H,22,27)
InChIKey RLLOSOPSPISKAN-UHFFFAOYSA-N
Mol Weight 411.52 g/mol
Molecular Formula C21H25N5O2S
Exact Mass 411.172896 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1PqWq0yRzZ6
Name N-[4-(dimethylamino)phenyl]-2-{[4-ethyl-5-(2-methoxyphenyl)-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/C21H25N5O2S/c1-5-26-20(17-8-6-7-9-18(17)28-4)23-24-21(26)29-14-19(27)22-15-10-12-16(13-11-15)25(2)3/h6-13H,5,14H2,1-4H3,(H,22,27)
InChIKey RLLOSOPSPISKAN-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4969
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: E08446; Labnumber: GRES-37072; SBI_ID: SBI-004971
Temperature 308 °C