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2-{[5-(1H-1,2,3-benzotriazol-1-ylmethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethoxyphenyl)acetamide
SpectraBase Compound ID A7bLxGleR97
InChI InChI=1S/C25H23N7O2S/c1-2-34-20-14-12-18(13-15-20)26-24(33)17-35-25-29-28-23(32(25)19-8-4-3-5-9-19)16-31-22-11-7-6-10-21(22)27-30-31/h3-15H,2,16-17H2,1H3,(H,26,33)
InChIKey TWRWUOGOFZDGHY-UHFFFAOYSA-N
Mol Weight 485.57 g/mol
Molecular Formula C25H23N7O2S
Exact Mass 485.163394 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DtDSRghidQJ
Name 2-{[5-(1H-1,2,3-benzotriazol-1-ylmethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethoxyphenyl)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/C25H23N7O2S/c1-2-34-20-14-12-18(13-15-20)26-24(33)17-35-25-29-28-23(32(25)19-8-4-3-5-9-19)16-31-22-11-7-6-10-21(22)27-30-31/h3-15H,2,16-17H2,1H3,(H,26,33)
InChIKey TWRWUOGOFZDGHY-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_2565
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/8056869; UBI_ID: UBI-002566
Temperature 308 °C