2-{[3-cyano-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydro-2-quinolinyl]sulfanyl}-N-(2-fluorophenyl)acetamide

SpectraBase Compound ID	ErHSIHnWW5a
InChI	InChI=1S/C27H26FN3O5S/c1-34-21-11-15(12-22(35-2)26(21)36-3)24-16(13-29)27(31-19-9-6-10-20(32)25(19)24)37-14-23(33)30-18-8-5-4-7-17(18)28/h4-5,7-8,11-12,24,31H,6,9-10,14H2,1-3H3,(H,30,33)
InChIKey	QVLPKWSCARNRCH-UHFFFAOYSA-N Google Search
Mol Weight	523.58 g/mol
Molecular Formula	C27H26FN3O5S
Exact Mass	523.15772 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	FyDnICr0pl9
Name	2-{[3-cyano-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydro-2-quinolinyl]sulfanyl}-N-(2-fluorophenyl)acetamide
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/C27H26FN3O5S/c1-34-21-11-15(12-22(35-2)26(21)36-3)24-16(13-29)27(31-19-9-6-10-20(32)25(19)24)37-14-23(33)30-18-8-5-4-7-17(18)28/h4-5,7-8,11-12,24,31H,6,9-10,14H2,1-3H3,(H,30,33)
InChIKey	QVLPKWSCARNRCH-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_22485
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: D59841; Labnumber: SHEL-0041; SBI_ID: SBI-022489
Temperature	308 °C