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2-{[5-[(2-chloro-5-methylphenoxy)methyl]-4-(tetrahydro-2-furanylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide

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2-{[5-[(2-chloro-5-methylphenoxy)methyl]-4-(tetrahydro-2-furanylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
SpectraBase Compound ID 8PlKwgNCkRx
InChI InChI=1S/C24H27ClN4O4S/c1-16-5-10-20(25)21(12-16)33-14-22-27-28-24(29(22)13-19-4-3-11-32-19)34-15-23(30)26-17-6-8-18(31-2)9-7-17/h5-10,12,19H,3-4,11,13-15H2,1-2H3,(H,26,30)
InChIKey QCDLUBRMEOXEOD-UHFFFAOYSA-N
Mol Weight 503.02 g/mol
Molecular Formula C24H27ClN4O4S
Exact Mass 502.144154 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3oVwZacdjA1
Name 2-{[5-[(2-chloro-5-methylphenoxy)methyl]-4-(tetrahydro-2-furanylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methoxyphenyl)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/C24H27ClN4O4S/c1-16-5-10-20(25)21(12-16)33-14-22-27-28-24(29(22)13-19-4-3-11-32-19)34-15-23(30)26-17-6-8-18(31-2)9-7-17/h5-10,12,19H,3-4,11,13-15H2,1-2H3,(H,26,30)
InChIKey QCDLUBRMEOXEOD-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_7710
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/1268984; Labnumber: COL5907; UZI_ID: UZI-007712
Temperature 318 °C