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

*Links on SpectraBase are not permalinks.

ethyl 2-({[(5-isopropyl-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

View entire compound with spectra: 1 NMR

ethyl 2-({[(5-isopropyl-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID FSY0jOmhnsi
InChI InChI=1S/C19H26N4O3S2/c1-5-26-18(25)15-12-8-6-7-9-13(12)28-17(15)20-14(24)10-27-19-22-21-16(11(2)3)23(19)4/h11H,5-10H2,1-4H3,(H,20,24)
InChIKey XQANPFABJQSYNZ-UHFFFAOYSA-N
Mol Weight 422.56 g/mol
Molecular Formula C19H26N4O3S2
Exact Mass 422.144633 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 I78QN2xDkqq
Name ethyl 2-({[(5-isopropyl-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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/C19H26N4O3S2/c1-5-26-18(25)15-12-8-6-7-9-13(12)28-17(15)20-14(24)10-27-19-22-21-16(11(2)3)23(19)4/h11H,5-10H2,1-4H3,(H,20,24)
InChIKey XQANPFABJQSYNZ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_8094
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: UZI/1268160; Labnumber: COL6782; UZI_ID: UZI-008096
Temperature 318 °C