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

SpectraBase Compound ID	8vicDoLpWEB
InChI	InChI=1S/C17H13F6N3O2S/c18-16(19,20)15(17(21,22)23,25-13(27)11-5-3-7-28-11)26-14-10(8-24)9-4-1-2-6-12(9)29-14/h3,5,7,26H,1-2,4,6H2,(H,25,27)
InChIKey	BRBNPKMMJYUUNN-UHFFFAOYSA-N Google Search
Mol Weight	437.36 g/mol
Molecular Formula	C17H13F6N3O2S
Exact Mass	437.063267 g/mol

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SpectraBase Spectrum ID	8VR7asTbvur
Name	N-[1-[(3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)amino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-2-furamide
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/C17H13F6N3O2S/c18-16(19,20)15(17(21,22)23,25-13(27)11-5-3-7-28-11)26-14-10(8-24)9-4-1-2-6-12(9)29-14/h3,5,7,26H,1-2,4,6H2,(H,25,27)
InChIKey	BRBNPKMMJYUUNN-UHFFFAOYSA-N
NMR Offset	18.0059
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_ASIOH_7000_4241
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/8315341; Labnumber: AU-ec00783; IOH_ID: IOH-004242
Temperature	303 °C