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2-[(4-Methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(trifluoromethoxy)phenyl]butanamide
SpectraBase Compound ID 7SYgRd1KmbX
InChI InChI=1S/C14H15F3N4O2S/c1-3-11(24-13-20-18-8-21(13)2)12(22)19-9-4-6-10(7-5-9)23-14(15,16)17/h4-8,11H,3H2,1-2H3,(H,19,22)
InChIKey WMKIHWUSJSACGJ-UHFFFAOYSA-N
Mol Weight 360.36 g/mol
Molecular Formula C14H15F3N4O2S
Exact Mass 360.086781 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6J0x2HTy5Ml
Name 2-[(4-Methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(trifluoromethoxy)phenyl]butanamide
CAS Registry Number 309282-56-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15F3N4O2S
InChI InChI=1S/C14H15F3N4O2S/c1-3-11(24-13-20-18-8-21(13)2)12(22)19-9-4-6-10(7-5-9)23-14(15,16)17/h4-8,11H,3H2,1-2H3,(H,19,22)
InChIKey WMKIHWUSJSACGJ-UHFFFAOYSA-N
Molecular Weight 360.355 g/mol
SMILES N(C(C(Sc1[n](cnn1)C)CC)=O)c1ccc(OC(F)(F)F)cc1
SPLASH splash10-00u6-5900000000-2410c22f707d2888c233
Source of Spectrum AD-0-2532-0
Synonyms 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(trifluoromethoxy)phenyl]butanamide 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(trifluoromethyloxy)phenyl]butanamide 2-[(4-methyl-1,2,4-triazol-3-yl)thio]-N-[4-(trifluoromethoxy)phenyl]butanamide 2-[(4-methyl-1,2,4-triazol-3-yl)thio]-N-[4-(trifluoromethoxy)phenyl]butyramide Butanamide, 2-(4-methyl-1,2,4-4H-triazolylthio)-N-(4-trifluoromethoxyphenyl)-
Wiley ID 1430686