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

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2-{[5-(4-chlorophenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dimethoxyphenyl)acetamide
SpectraBase Compound ID HP7AQSBk6IK
InChI InChI=1S/C25H23ClN4O4S/c1-32-19-10-8-18(9-11-19)30-24(16-4-6-17(26)7-5-16)28-29-25(30)35-15-23(31)27-21-13-12-20(33-2)14-22(21)34-3/h4-14H,15H2,1-3H3,(H,27,31)
InChIKey CEAAAPCQCSVSEM-UHFFFAOYSA-N
Mol Weight 511.0 g/mol
Molecular Formula C25H23ClN4O4S
Exact Mass 510.112854 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3TAzU5wnfJV
Name 2-{[5-(4-chlorophenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dimethoxyphenyl)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/C25H23ClN4O4S/c1-32-19-10-8-18(9-11-19)30-24(16-4-6-17(26)7-5-16)28-29-25(30)35-15-23(31)27-21-13-12-20(33-2)14-22(21)34-3/h4-14H,15H2,1-3H3,(H,27,31)
InChIKey CEAAAPCQCSVSEM-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4570
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: D99195; Labnumber: GRES-32935; SBI_ID: SBI-004572
Temperature 315 °C