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2-{[5-(2-fluorophenyl)-4-(2-furylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
SpectraBase Compound ID Kt58fCBDNBT
InChI InChI=1S/C22H19FN4O3S/c1-29-16-10-8-15(9-11-16)24-20(28)14-31-22-26-25-21(18-6-2-3-7-19(18)23)27(22)13-17-5-4-12-30-17/h2-12H,13-14H2,1H3,(H,24,28)
InChIKey JLEWQKRTXUOZHH-UHFFFAOYSA-N
Mol Weight 438.48 g/mol
Molecular Formula C22H19FN4O3S
Exact Mass 438.11619 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9B8WR51ih3a
Name 2-{[5-(2-fluorophenyl)-4-(2-furylmethyl)-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/C22H19FN4O3S/c1-29-16-10-8-15(9-11-16)24-20(28)14-31-22-26-25-21(18-6-2-3-7-19(18)23)27(22)13-17-5-4-12-30-17/h2-12H,13-14H2,1H3,(H,24,28)
InChIKey JLEWQKRTXUOZHH-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11468
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: E06371; Labnumber: GRES-21570; SBI_ID: SBI-011471
Temperature 308 °C