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

*Links on SpectraBase are not permalinks.
N-(2-thenyl)-2-[2-[3-(trifluoromethyl)phenyl]sulfonylethylthio]nicotinamide
SpectraBase Compound ID FOAdieIn6aC
InChI InChI=1S/C20H17F3N2O3S3/c21-20(22,23)14-4-1-6-16(12-14)31(27,28)11-10-30-19-17(7-2-8-24-19)18(26)25-13-15-5-3-9-29-15/h1-9,12H,10-11,13H2,(H,25,26)
InChIKey XJCSYWYPHUIOJY-UHFFFAOYSA-N
Mol Weight 486.54 g/mol
Molecular Formula C20H17F3N2O3S3
Exact Mass 486.03534 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 5jTh2GDtw8P
Name N-(2-thenyl)-2-[2-[3-(trifluoromethyl)phenyl]sulfonylethylthio]nicotinamide
Alternate Name(s) N-(2-thienylmethyl)-2-[2-[3-(trifluoromethyl)phenyl]sulfonylethylsulfanyl]pyridine-3-carboxamide N-(thiophen-2-ylmethyl)-2-[2-[3-(trifluoromethyl)phenyl]sulfonylethylsulfanyl]pyridine-3-carboxamide N-(thiophen-2-ylmethyl)-2-[2-[3-(trifluoromethyl)phenyl]sulfonylethylthio]-3-pyridinecarboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H17F3N2O3S3
InChI InChI=1S/C20H17F3N2O3S3/c21-20(22,23)14-4-1-6-16(12-14)31(27,28)11-10-30-19-17(7-2-8-24-19)18(26)25-13-15-5-3-9-29-15/h1-9,12H,10-11,13H2,(H,25,26)
InChIKey XJCSYWYPHUIOJY-UHFFFAOYSA-N
Molecular Weight 486.542 g/mol
SMILES N(C(c1c(SCCS(c2cc(C(F)(F)F)ccc2)(=O)=O)nccc1)=O)Cc1sccc1
SPLASH splash10-01ot-8920000000-f934c2900ec47a02e26c
Wiley ID 1446654