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

*Links on SpectraBase are not permalinks.
2-[[4-keto-6-(trifluoromethyl)-1H-pyrimidin-2-yl]thio]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide
SpectraBase Compound ID 5b9yzFUWMQt
InChI InChI=1S/C21H15F3N4O2S2/c1-11-2-7-14-15(8-11)32-19(26-14)12-3-5-13(6-4-12)25-18(30)10-31-20-27-16(21(22,23)24)9-17(29)28-20/h2-9H,10H2,1H3,(H,25,30)(H,27,28,29)
InChIKey HEROXKZLVOQHOL-UHFFFAOYSA-N
Mol Weight 476.49 g/mol
Molecular Formula C21H15F3N4O2S2
Exact Mass 476.058853 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 4BU0F4ZXwWf
Name 2-[[4-keto-6-(trifluoromethyl)-1H-pyrimidin-2-yl]thio]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H15F3N4O2S2
InChI InChI=1S/C21H15F3N4O2S2/c1-11-2-7-14-15(8-11)32-19(26-14)12-3-5-13(6-4-12)25-18(30)10-31-20-27-16(21(22,23)24)9-17(29)28-20/h2-9H,10H2,1H3,(H,25,30)(H,27,28,29)
InChIKey HEROXKZLVOQHOL-UHFFFAOYSA-N
Molecular Weight 476.492 g/mol
SMILES N(C(CSC1=NC(=CC(N1)=O)C(F)(F)F)=O)c1ccc(-c2nc3ccc(cc3s2)C)cc1
SPLASH splash10-0007-9430000000-5e1945b249f4365bf6a6
Synonyms N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-[[4-oxidanylidene-6-(trifluoromethyl)-1H-pyrimidin-2-yl]sulfanyl]ethanamide N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-[[4-oxo-6-(trifluoromethyl)-1H-pyrimidin-2-yl]sulfanyl]acetamide N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-[[4-oxo-6-(trifluoromethyl)-1H-pyrimidin-2-yl]thio]acetamide
Wiley ID 1464154