For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

1-(heptylsulfanyl)-4-(4-methoxyphenyl)-7,8,9,10-tetrahydro-6H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one

View entire compound with spectra: 1 NMR

1-(heptylsulfanyl)-4-(4-methoxyphenyl)-7,8,9,10-tetrahydro-6H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
SpectraBase Compound ID Dqv5U4H6Ynz
InChI InChI=1S/C26H32N4O2S2/c1-3-4-5-6-10-17-33-26-28-27-25-29(18-13-15-19(32-2)16-14-18)23(31)22-20-11-8-7-9-12-21(20)34-24(22)30(25)26/h13-16H,3-12,17H2,1-2H3
InChIKey ALFUKDWLERVPPJ-UHFFFAOYSA-N
Mol Weight 496.7 g/mol
Molecular Formula C26H32N4O2S2
Exact Mass 496.196669 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 42rwk0KKlfA
Name 1-(heptylsulfanyl)-4-(4-methoxyphenyl)-7,8,9,10-tetrahydro-6H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
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/C26H32N4O2S2/c1-3-4-5-6-10-17-33-26-28-27-25-29(18-13-15-19(32-2)16-14-18)23(31)22-20-11-8-7-9-12-21(20)34-24(22)30(25)26/h13-16H,3-12,17H2,1-2H3
InChIKey ALFUKDWLERVPPJ-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_12267
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: 801313; Labnumber: AE95-860; VK_ID: VK-012272
Temperature 313 °C