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1-(2,4-Dimethyl-phenyl)-2-(4-hydroxy-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-ylsulfanyl)-ethanone
SpectraBase Compound ID 1SV1WsKbTcc
InChI InChI=1S/C18H18N2O2S2/c1-9-5-6-13(10(2)7-9)14(21)8-23-18-19-16(22)15-11(3)12(4)24-17(15)20-18/h5-7H,8H2,1-4H3,(H,19,20,22)
InChIKey XKXWIUAMFNZCLD-UHFFFAOYSA-N
Mol Weight 358.47 g/mol
Molecular Formula C18H18N2O2S2
Exact Mass 358.08097 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7FL4JfsbPQS
Name 1-(2,4-Dimethyl-phenyl)-2-(4-hydroxy-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-ylsulfanyl)-ethanone
Alternate Name(s) 2-[2-(2,4-dimethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one 2-[2-(2,4-dimethylphenyl)-2-oxo-ethyl]sulfanyl-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one 2-[[2-(2,4-dimethylphenyl)-2-keto-ethyl]thio]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one 2-[[2-(2,4-dimethylphenyl)-2-oxoethyl]thio]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one
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Formula C18H18N2O2S2
InChI InChI=1S/C18H18N2O2S2/c1-9-5-6-13(10(2)7-9)14(21)8-23-18-19-16(22)15-11(3)12(4)24-17(15)20-18/h5-7H,8H2,1-4H3,(H,19,20,22)
InChIKey XKXWIUAMFNZCLD-UHFFFAOYSA-N
Molecular Weight 358.474 g/mol
SMILES Oc1c2c(nc(n1)SCC(c1c(cc(cc1)C)C)=O)sc(C)c2C
SPLASH splash10-001i-4900000000-f4efa89db390829dd089
Wiley ID 1454190