N-[1-[(3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)amino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-2-methylpropanamide

SpectraBase Compound ID	EwfLPSxqq7a
InChI	InChI=1S/C16H17F6N3OS/c1-8(2)12(26)24-14(15(17,18)19,16(20,21)22)25-13-10(7-23)9-5-3-4-6-11(9)27-13/h8,25H,3-6H2,1-2H3,(H,24,26)
InChIKey	HVXZBGVLRVFSJZ-UHFFFAOYSA-N Google Search
Mol Weight	413.38 g/mol
Molecular Formula	C16H17F6N3OS
Exact Mass	413.099652 g/mol

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SpectraBase Spectrum ID	EbxpzDrTC0m
Name	N-[1-[(3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)amino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-2-methylpropanamide
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/C16H17F6N3OS/c1-8(2)12(26)24-14(15(17,18)19,16(20,21)22)25-13-10(7-23)9-5-3-4-6-11(9)27-13/h8,25H,3-6H2,1-2H3,(H,24,26)
InChIKey	HVXZBGVLRVFSJZ-UHFFFAOYSA-N
NMR Offset	17.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_7529_2892
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: NMR/9254009; Labnumber: AU-0000916