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1-(4-chlorophenyl)-2-{[4-(2-furylmethyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone

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1-(4-chlorophenyl)-2-{[4-(2-furylmethyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
SpectraBase Compound ID 180EwiD5y3Z
InChI InChI=1S/C20H15ClN4O2S/c21-16-7-5-14(6-8-16)18(26)13-28-20-24-23-19(15-3-1-9-22-11-15)25(20)12-17-4-2-10-27-17/h1-11H,12-13H2
InChIKey XKUVXZSYTNDQRE-UHFFFAOYSA-N
Mol Weight 410.88 g/mol
Molecular Formula C20H15ClN4O2S
Exact Mass 410.060425 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID H7y7MakxmrD
Name 1-(4-chlorophenyl)-2-{[4-(2-furylmethyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
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/C20H15ClN4O2S/c21-16-7-5-14(6-8-16)18(26)13-28-20-24-23-19(15-3-1-9-22-11-15)25(20)12-17-4-2-10-27-17/h1-11H,12-13H2
InChIKey XKUVXZSYTNDQRE-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_27069
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: D75221; Labnumber: GRESKO-5325; SBI_ID: SBI-027073
Temperature 318 °C