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2-[2-(5-methyl-2-furyl)-2-oxo-ethyl]sulfanyl-3-phenyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one
SpectraBase Compound ID 8rxjRRyRRzK
InChI InChI=1S/C23H20N2O3S2/c1-14-11-12-18(28-14)17(26)13-29-23-24-21-20(16-9-5-6-10-19(16)30-21)22(27)25(23)15-7-3-2-4-8-15/h2-4,7-8,11-12H,5-6,9-10,13H2,1H3
InChIKey FKLMZHKVNFTDPI-UHFFFAOYSA-N
Mol Weight 436.54 g/mol
Molecular Formula C23H20N2O3S2
Exact Mass 436.091535 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5qegJnIRrjK
Name 2-[2-(5-methyl-2-furyl)-2-oxo-ethyl]sulfanyl-3-phenyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one
Alternate Name(s) 2-[2-(5-methylfuran-2-yl)-2-oxidanylidene-ethyl]sulfanyl-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one 2-[2-(5-methylfuran-2-yl)-2-oxoethyl]sulfanyl-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one 2-[[2-(5-methyl-2-furanyl)-2-oxoethyl]thio]-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one 2-[[2-keto-2-(5-methyl-2-furyl)ethyl]thio]-3-phenyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one
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Formula C23H20N2O3S2
InChI InChI=1S/C23H20N2O3S2/c1-14-11-12-18(28-14)17(26)13-29-23-24-21-20(16-9-5-6-10-19(16)30-21)22(27)25(23)15-7-3-2-4-8-15/h2-4,7-8,11-12H,5-6,9-10,13H2,1H3
InChIKey FKLMZHKVNFTDPI-UHFFFAOYSA-N
Molecular Weight 436.544 g/mol
SMILES c12sc3c(c2C(N(C(=N1)SCC(=O)c1oc(cc1)C)c1ccccc1)=O)CCCC3
SPLASH splash10-0a73-9831100000-3c5f194ccb3977603781
Wiley ID 1444250