S-[4-methyl-5-(5-methyl-3-thienyl)-4H-1,2,4-triazol-3-yl] 2-(4-butoxyphenyl)-4-quinolinecarbothioate

SpectraBase Compound ID	8RbYA2UTlwc
InChI	InChI=1S/C28H26N4O2S2/c1-4-5-14-34-21-12-10-19(11-13-21)25-16-23(22-8-6-7-9-24(22)29-25)27(33)36-28-31-30-26(32(28)3)20-15-18(2)35-17-20/h6-13,15-17H,4-5,14H2,1-3H3
InChIKey	LBTFAMBZMCIBIY-UHFFFAOYSA-N Google Search
Mol Weight	514.66 g/mol
Molecular Formula	C28H26N4O2S2
Exact Mass	514.149718 g/mol

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SpectraBase Spectrum ID	6keSpRhyA7A
Name	S-[4-methyl-5-(5-methyl-3-thienyl)-4H-1,2,4-triazol-3-yl] 2-(4-butoxyphenyl)-4-quinolinecarbothioate
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/C28H26N4O2S2/c1-4-5-14-34-21-12-10-19(11-13-21)25-16-23(22-8-6-7-9-24(22)29-25)27(33)36-28-31-30-26(32(28)3)20-15-18(2)35-17-20/h6-13,15-17H,4-5,14H2,1-3H3
InChIKey	LBTFAMBZMCIBIY-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_6645
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/1266374; Labnumber: COL3017; UZI_ID: UZI-006647
Temperature	318 °C