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2-[(4-oxo-3-phenyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide

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2-[(4-oxo-3-phenyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
SpectraBase Compound ID Kstpw1nYIV1
InChI InChI=1S/C24H18F3N3O2S2/c25-24(26,27)14-6-4-7-15(12-14)28-19(31)13-33-23-29-21-20(17-10-5-11-18(17)34-21)22(32)30(23)16-8-2-1-3-9-16/h1-4,6-9,12H,5,10-11,13H2,(H,28,31)
InChIKey LZKOROHXVHNACE-UHFFFAOYSA-N
Mol Weight 501.54 g/mol
Molecular Formula C24H18F3N3O2S2
Exact Mass 501.079254 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 53m9EypEbg
Name 2-[(4-oxo-3-phenyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
Alternate Name(s) 2-[(1-oxo-2-phenyl-7,8-dihydro-6H-cyclopenta[2,3]thieno[2,4-b]pyrimidin-3-yl)thio]-N-[3-(trifluoromethyl)phenyl]acetamide 2-[(1-oxo-2-phenyl-7,8-dihydro-6H-cyclopenta[2,3]thieno[2,4-b]pyrimidin-3-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide 2-[(1-oxidanylidene-2-phenyl-7,8-dihydro-6H-cyclopenta[2,3]thieno[2,4-b]pyrimidin-3-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]ethanamide
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Formula C24H18F3N3O2S2
InChI InChI=1S/C24H18F3N3O2S2/c25-24(26,27)14-6-4-7-15(12-14)28-19(31)13-33-23-29-21-20(17-10-5-11-18(17)34-21)22(32)30(23)16-8-2-1-3-9-16/h1-4,6-9,12H,5,10-11,13H2,(H,28,31)
InChIKey LZKOROHXVHNACE-UHFFFAOYSA-N
Molecular Weight 501.542 g/mol
SMILES N(C(CSC=1N(C(c2c(N1)sc1c2CCC1)=O)c1ccccc1)=O)c1cc(C(F)(F)F)ccc1
SPLASH splash10-0hkc-9621000000-b282d9a9023c51a02175
Wiley ID 1443909