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3-[4-(2-furyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-methyl-N-[4-(trifluoromethoxy)phenyl]propanamide
SpectraBase Compound ID 1HBMOmKa5Uu
InChI InChI=1S/C20H15F6N3O3S/c1-29(12-4-6-13(7-5-12)32-20(24,25)26)17(30)8-10-33-18-27-14(15-3-2-9-31-15)11-16(28-18)19(21,22)23/h2-7,9,11H,8,10H2,1H3
InChIKey KNHUMNVIBCRVPG-UHFFFAOYSA-N
Mol Weight 491.41 g/mol
Molecular Formula C20H15F6N3O3S
Exact Mass 491.073832 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4gH9mDkW0xZ
Name 3-[4-(2-furyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-methyl-N-[4-(trifluoromethoxy)phenyl]propanamide
Alternate Name(s) 3-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-methyl-N-[4-(trifluoromethoxy)phenyl]propanamide 3-[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-methyl-N-[4-(trifluoromethyloxy)phenyl]propanamide 3-[[4-(2-furanyl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]-N-methyl-N-[4-(trifluoromethoxy)phenyl]propanamide 3-[[4-(2-furyl)-6-(trifluoromethyl)pyrimidin-2-yl]thio]-N-methyl-N-[4-(trifluoromethoxy)phenyl]propionamide
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Formula C20H15F6N3O3S
InChI InChI=1S/C20H15F6N3O3S/c1-29(12-4-6-13(7-5-12)32-20(24,25)26)17(30)8-10-33-18-27-14(15-3-2-9-31-15)11-16(28-18)19(21,22)23/h2-7,9,11H,8,10H2,1H3
InChIKey KNHUMNVIBCRVPG-UHFFFAOYSA-N
Molecular Weight 491.408 g/mol
SMILES C(c1nc(nc(c1)-c1occc1)SCCC(N(c1ccc(OC(F)(F)F)cc1)C)=O)(F)(F)F
SPLASH splash10-006w-6690000000-318a2fcb9a454f580347
Wiley ID 1443494