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2-[4-benzyl-5-(methylsulfanyl)-4H-1,2,4-triazol-3-yl]-6-(4-chlorophenyl)-4-phenylfuro[2,3-b]pyridin-3-amine
SpectraBase Compound ID 6PxXMRt4yqI
InChI InChI=1S/C29H22ClN5OS/c1-37-29-34-33-27(35(29)17-18-8-4-2-5-9-18)26-25(31)24-22(19-10-6-3-7-11-19)16-23(32-28(24)36-26)20-12-14-21(30)15-13-20/h2-16H,17,31H2,1H3
InChIKey WYSUXFWCUZZDLF-UHFFFAOYSA-N
Mol Weight 524.04 g/mol
Molecular Formula C29H22ClN5OS
Exact Mass 523.123359 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID H9jQGk2LyuG
Name 2-[4-benzyl-5-(methylsulfanyl)-4H-1,2,4-triazol-3-yl]-6-(4-chlorophenyl)-4-phenylfuro[2,3-b]pyridin-3-amine
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/C29H22ClN5OS/c1-37-29-34-33-27(35(29)17-18-8-4-2-5-9-18)26-25(31)24-22(19-10-6-3-7-11-19)16-23(32-28(24)36-26)20-12-14-21(30)15-13-20/h2-16H,17,31H2,1H3
InChIKey WYSUXFWCUZZDLF-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_14016
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: MAY-13/0093; UBI_ID: UBI-014019
Synonyms 2-[4-benzyl-5-(methylsulfanyl)-4H-1,2,4-triazol-3-yl]-6-(4-chlorophenyl)-4-phenylfuro[2,3-b]pyridin-3-ylamine
Temperature 318 °C